1-(3-anilino-3-oxopropyl)-N-[4-(propan-2-yl)phenyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-(3-anilino-3-oxopropyl)-N-[4-(propan-2-yl)phenyl]-1H-benzotriazole-5-carboxamide
1-(3-anilino-3-oxopropyl)-N-[4-(propan-2-yl)phenyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | M281-4718 |
| Compound Name: | 1-(3-anilino-3-oxopropyl)-N-[4-(propan-2-yl)phenyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 427.51 |
| Molecular Formula: | C25 H25 N5 O2 |
| Smiles: | CC(C)c1ccc(cc1)NC(c1ccc2c(c1)nnn2CCC(Nc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2912 |
| logD: | 4.2911 |
| logSw: | -4.1979 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.883 |
| InChI Key: | BYWJPIPGDRPPGE-UHFFFAOYSA-N |