N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(pyrrolidin-1-yl)benzamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(pyrrolidin-1-yl)benzamide
N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(pyrrolidin-1-yl)benzamide
Compound characteristics
| Compound ID: | K786-3259 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(pyrrolidin-1-yl)benzamide |
| Molecular Weight: | 558.49 |
| Molecular Formula: | C26 H28 Br N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(Nc1cc(ccc1N1CCCC1)C(NCc1cc(ccc1OC)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.591 |
| logD: | 3.764 |
| logSw: | -5.3651 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.752 |
| InChI Key: | DOAPILPOVSQDOP-UHFFFAOYSA-N |