N-(propan-2-yl)-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(propan-2-yl)-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide
N-(propan-2-yl)-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G373-3710 |
| Compound Name: | N-(propan-2-yl)-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 456.5 |
| Molecular Formula: | C22 H28 N6 O5 |
| Smiles: | CC(C)NC(c1ccc2c(c1)nnn2CCNC(Nc1cc(c(c(c1)OC)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3628 |
| logD: | 1.3627 |
| logSw: | -2.1921 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.018 |
| InChI Key: | UWXXCPTVBBGEHI-UHFFFAOYSA-N |