1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N-cyclopentyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N-cyclopentyl-1H-benzotriazole-5-carboxamide
1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N-cyclopentyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0515 |
| Compound Name: | 1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N-cyclopentyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 456.93 |
| Molecular Formula: | C22 H25 Cl N6 O3 |
| Smiles: | COc1ccc(cc1NC(NCCn1c2ccc(cc2nn1)C(NC1CCCC1)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9594 |
| logD: | 2.9588 |
| logSw: | -3.7255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.818 |
| InChI Key: | PFWWEYVGKPXCJO-UHFFFAOYSA-N |