1-{2-[(2-methoxy-5-methylphenyl)carbamamido]ethyl}-N-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-{2-[(2-methoxy-5-methylphenyl)carbamamido]ethyl}-N-(propan-2-yl)-1H-benzotriazole-5-carboxamide
1-{2-[(2-methoxy-5-methylphenyl)carbamamido]ethyl}-N-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0466 |
| Compound Name: | 1-{2-[(2-methoxy-5-methylphenyl)carbamamido]ethyl}-N-(propan-2-yl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C21 H26 N6 O3 |
| Smiles: | CC(C)NC(c1ccc2c(c1)nnn2CCNC(Nc1cc(C)ccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8201 |
| logD: | 1.8201 |
| logSw: | -2.3073 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.973 |
| InChI Key: | RSBPBGUXYZROAZ-UHFFFAOYSA-N |