1-{2-[(3-chloro-4-methoxyphenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-{2-[(3-chloro-4-methoxyphenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide
1-{2-[(3-chloro-4-methoxyphenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G373-3731 |
| Compound Name: | 1-{2-[(3-chloro-4-methoxyphenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 444.92 |
| Molecular Formula: | C21 H25 Cl N6 O3 |
| Smiles: | CCN(CC)C(c1ccc2c(c1)nnn2CCNC(Nc1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3206 |
| logD: | 2.3205 |
| logSw: | -3.5076 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.943 |
| InChI Key: | UKLMVXHVGROIED-UHFFFAOYSA-N |