N-cyclopentyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide
N-cyclopentyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0565 |
| Compound Name: | N-cyclopentyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C18 H26 N6 O2 |
| Smiles: | CC(C)NC(NCCn1c2ccc(cc2nn1)C(NC1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4517 |
| logD: | 1.4517 |
| logSw: | -2.1872 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.453 |
| InChI Key: | VHTTYSDIZZRAOD-UHFFFAOYSA-N |