N-[2-(4-acetylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-acetylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
N-[2-(4-acetylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G851-0929 |
| Compound Name: | N-[2-(4-acetylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C21 H23 N5 O3 |
| Smiles: | CC(C)n1c2ccc(cc2nn1)C(N(C)CC(Nc1ccc(cc1)C(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6927 |
| logD: | 1.6924 |
| logSw: | -2.4272 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.531 |
| InChI Key: | WMZMRDWVTITLNB-UHFFFAOYSA-N |