N-[4-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine
Structure Info
- Chemspace ID
- CSSB00000501875 (In-Stock Building Blocks)
- MFCD
- MFCD11177748, MFCD11177748
- IUPAC Name
- N-[4-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine
- Mol formula
- C14H12N2S2
- Mol weight
- 272 Da
- Catalog Number(s)
- BBV-206820, CSC000501875, CSCR00022316844, SC-56973, s_27____136173____103009
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.87
- Heavy atoms count
- 18
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.071
- Polar surface area (Å)
- 25
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
![Chemical structure of N-[4-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine (C14H12N2S2) - CSSB00000501875](/st/structure/200/580d320ca743dd7f19cb4808933f3d1c/CSC1%253DCC%253DC%2528NC2%253DNC3%253DCC%253DCC%253DC3S2%2529C%253DC1.png "C14H12N2S2")
- Zoom the structure
- CSSB00000501875
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Substructure Analogs
![Chemical structure of 6-chloro-N-[4-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine - CSSB00020652135](/st/structure/200/0d6246a3bc5e33056a1819c9b9ffcd1e/CSC1%253DCC%253DC%2528NC2%253DNC3%253DCC%253DC%2528Cl%2529C%253DC3S2%2529C%253DC1.png)
![Chemical structure of 6-methoxy-N-[4-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine - CSSB00020652136](/st/structure/200/0eda18995f6f090dac2fb7b73cbad932/COC1%253DCC%253DC2N%253DC%2528NC3%253DCC%253DC%2528SC%2529C%253DC3%2529SC2%253DC1.png)
![Chemical structure of N-{4-[(difluoromethyl)sulfanyl]phenyl}-1,3-benzothiazol-2-amine - CSSB00000680976](/st/structure/200/fc68c2cc231beb791b1d03f33d10a223/FC%2528F%2529SC1%253DCC%253DC%2528NC2%253DNC3%253DCC%253DCC%253DC3S2%2529C%253DC1.png)
Similarity Analogs
![Chemical structure of N-[3-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine - CSSB00000392790](/st/structure/200/83dba96faf78e694298aa0e356235bba/CSC1%253DCC%253DCC%2528NC2%253DNC3%253DCC%253DCC%253DC3S2%2529%253DC1.png)
![Chemical structure of N-[2-(methylsulfanyl)phenyl]-1,3-benzothiazol-2-amine - CSSB00000494966](/st/structure/200/90c895d751751785a202cfed1f3ccff1/CSC1%253DCC%253DCC%253DC1NC1%253DNC2%253DCC%253DCC%253DC2S1.png)
