N-[3-({(3-chlorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)-4-(dimethylamino)phenyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[3-({(3-chlorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)-4-(dimethylamino)phenyl]furan-2-carboxamide
N-[3-({(3-chlorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)-4-(dimethylamino)phenyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | V027-0050 |
| Compound Name: | N-[3-({(3-chlorobenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}methyl)-4-(dimethylamino)phenyl]furan-2-carboxamide |
| Molecular Weight: | 542.03 |
| Molecular Formula: | C27 H25 Cl F N3 O4 S |
| Salt: | not_available |
| Smiles: | CN(C)c1ccc(cc1CN(Cc1ccc(cc1)F)S(c1cccc(c1)[Cl])(=O)=O)NC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7078 |
| logD: | 5.706 |
| logSw: | -5.8577 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.516 |
| InChI Key: | QCHWNYSDYPZWRC-UHFFFAOYSA-N |