N-(propan-2-yl)-1-[2-(propylcarbamamido)ethyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(propan-2-yl)-1-[2-(propylcarbamamido)ethyl]-1H-benzotriazole-5-carboxamide
N-(propan-2-yl)-1-[2-(propylcarbamamido)ethyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0469 |
| Compound Name: | N-(propan-2-yl)-1-[2-(propylcarbamamido)ethyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C16 H24 N6 O2 |
| Smiles: | CCCNC(NCCn1c2ccc(cc2nn1)C(NC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6986 |
| logD: | 0.6986 |
| logSw: | -2.0842 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.475 |
| InChI Key: | VNCNHRVJKAGMOY-UHFFFAOYSA-N |