1-{4-[(1,3-benzothiazol-2-yl)amino]phenyl}ethan-1-one
Structure Info
- Chemspace ID
- CSSB00000680913 (In-Stock Building Blocks)
- CAS
- 74661-40-8
- MFCD
- MFCD02725636
- IUPAC Name
- 1-{4-[(1,3-benzothiazol-2-yl)amino]phenyl}ethan-1-one
- Mol formula
- C15H12N2OS
- Mol weight
- 268 Da
- Catalog Number(s)
- A1007749, AG019H2M, AR019HRM, AV21446, BB4LS-EN300-02341, BBLS00000680913, BBV-38774127, BD00981591, CS-0218869, CSC000680913, EN300-02341, G36124, HY-W161469, ST019IJE, TX019I8A, Y3137734, Z55176268, ZXC340168, bbls00000680913
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.8
- Heavy atoms count
- 19
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.066
- Polar surface area (Å)
- 42
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of 1-{4-[(1,3-benzothiazol-2-yl)amino]phenyl}ethan-1-one (C15H12N2OS) - CSSB00000680913](/st/structure/200/5ed0434be8cc9727a5a061c6b794eeae/CC%2528%253DO%2529C1%253DCC%253DC%2528NC2%253DNC3%253DCC%253DCC%253DC3S2%2529C%253DC1.png "C15H12N2OS")
- Zoom the structure
- CSSB00000680913
Items Overall 17 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 42.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 66.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 92.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 175.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 102.30 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 129.80 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 159.50 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 256.30 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 349.80 | |
Description: 1-{4-[(1,3-benzothiazol-2-yl)amino]phenyl}ethan-1-one; CAS: 74661-40-8 | ||||||
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 42.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 66.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 92.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 175.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 256.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 503.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 743.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 1,101.00 | |
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Substructure Analogs
![Chemical structure of 6-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-10-methyl-9λ⁶-thia-10-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene-2,9,9-trione - CSSB21531607851](/st/structure/200/80d4b08f8b4fbe6355614dd533f5c5f9/COC1%253DCC%253DC2N%253DC%2528%255BNH%253A1%255D%255BC%253A1%255D3%253DCC%253DC4C%2528%253DC3%2529S%2528%253DO%2529%2528%253DO%2529N%2528C%2529C3%253DCC%253DCC%253DC3C4%253DO%2529SC2%253DC1.png)
Similarity Analogs
![Chemical structure of 1-[4-(1,3-benzothiazol-2-yl)phenyl]ethan-1-one - CSSB00112983865](/st/structure/200/fa814904a457e3966172028d6ba18056/CC%2528%253DO%2529C1%253DCC%253DC%2528C%253DC1%2529C1%253DNC2%253DCC%253DCC%253DC2S1.png)
![Chemical structure of N-[4-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine - CSSB00000501875](/st/structure/200/580d320ca743dd7f19cb4808933f3d1c/CSC1%253DCC%253DC%2528NC2%253DNC3%253DCC%253DCC%253DC3S2%2529C%253DC1.png)
![Chemical structure of N-[4-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-amine - CSSB00020652118](/st/structure/200/11e9124666385d864c6c424f771f2765/FC%2528F%2529%2528F%2529C1%253DCC%253DC%2528NC2%253DNC3%253DCC%253DCC%253DC3S2%2529C%253DC1.png)
![Chemical structure of N-[4-(propan-2-yl)phenyl]-1,3-benzothiazol-2-amine - CSSB00000680954](/st/structure/200/b733a89aff12ee5c46061bd2f6a2229b/CC%2528C%2529C1%253DCC%253DC%2528NC2%253DNC3%253DCC%253DCC%253DC3S2%2529C%253DC1.png)
