N-[3-(4-acetamidoanilino)-3-oxopropyl]-1-propyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[3-(4-acetamidoanilino)-3-oxopropyl]-1-propyl-1H-benzotriazole-5-carboxamide
N-[3-(4-acetamidoanilino)-3-oxopropyl]-1-propyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G851-0694 |
| Compound Name: | N-[3-(4-acetamidoanilino)-3-oxopropyl]-1-propyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | CCCn1c2ccc(cc2nn1)C(NCCC(Nc1ccc(cc1)NC(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1761 |
| logD: | 1.1761 |
| logSw: | -2.1444 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.58 |
| InChI Key: | DTYLBFDUUGRIGC-UHFFFAOYSA-N |