N-(4-methylphenyl)-2H-1,3-benzodioxole-5-carboxamide
Structure Info
- Chemspace ID
- CSSB00026316827 (In-Stock Building Blocks)
- CAS
- 349113-96-8
- MFCD
- MFCD01269237, MFCD01269237
- IUPAC Name
- N-(4-methylphenyl)-2H-1,3-benzodioxole-5-carboxamide
- Mol formula
- C15H13NO3
- Mol weight
- 255 Da
- Catalog Number(s)
- AA0299XT, AG-690/13115999, BBV-565917381, BL91917, CSC026316827, CSCR00025599886, LN01132297, PB28212270, ST029BHD, TX029B69, Z28134802, a1_160714_54454, s11____378740____53580, s11____51366____53580, s1626____22020472____511300, s1626____513300____511300, s22____378746____58981, s22____57728____58981, s527____154044____156223, s527____378786____156223, s_527_154044_156223, s_527____154044____156223
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.2
- Heavy atoms count
- 19
- Rotatable bond count
- 2
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.133
- Polar surface area (Å)
- 48
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSB00026316827
Items Overall 4 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 14 days | United States To: | 90 | 10 mg | 245.30 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 50 mg | 288.20 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 100 mg | 317.90 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 500 mg | 643.50 | |
Description: N-(4-methylphenyl)-1,3-benzodioxole-5-carboxamide; CAS: 349113-96-8 | ||||||
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Substructure Analogs
![Chemical structure of N-[4-(aminomethyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide - CSSB00020654014](/st/structure/200/effc9d13ed95ff569300e10d0e82d37a/NCC1%253DCC%253DC%2528NC%2528%253DO%2529C2%253DCC%253DC3OCOC3%253DC2%2529C%253DC1.png)
![Chemical structure of N-[4-(cyanomethyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide - CSSB00020600357](/st/structure/200/4e599a72da84a477aa2dfac0acd86902/O%253DC%2528NC1%253DCC%253DC%2528CC%2523N%2529C%253DC1%2529C1%253DCC%253DC2OCOC2%253DC1.png)
![Chemical structure of 2,2-difluoro-N-{3-[2-(2-hydroxyethoxy)-6-(morpholin-4-yl)pyridin-4-yl]-4-methylphenyl}-2H-1,3-benzodioxole-5-carboxamide - CSSB06630656091](/st/structure/200/e81bbc77d0a6d797dd6a1d6a69c841b4/Cc1ccc%2528NC%2528%253DO%2529c2ccc3OC%2528F%2529%2528F%2529Oc3c2%2529cc1-c1cc%2528OCCO%2529nc%2528c1%2529N1CCOCC1.png)
Similarity Analogs
![Chemical structure of N-[(4-methylphenyl)methyl]-2H-1,3-benzodioxole-5-carboxamide - CSSB00026328601](/st/structure/200/a99b5ef6fcfbf8517fad6ba8b488b2f4/CC1%253DCC%253DC%2528CNC%2528%253DO%2529C2%253DCC%253DC3OCOC3%253DC2%2529C%253DC1.png)
