N-(3-chloro-4-methoxyphenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
N-(3-chloro-4-methoxyphenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F514-0115 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide |
| Molecular Weight: | 463.94 |
| Molecular Formula: | C20 H22 Cl N5 O4 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CCn1c2ccc(cc2nn1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6221 |
| logD: | 2.6213 |
| logSw: | -3.543 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.5 |
| InChI Key: | RGMZDVUETSSGQQ-UHFFFAOYSA-N |