N-(3-cyanophenyl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}butanamide
Chemical Structure Depiction of
N-(3-cyanophenyl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}butanamide
N-(3-cyanophenyl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}butanamide
Compound characteristics
| Compound ID: | J037-0064 |
| Compound Name: | N-(3-cyanophenyl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}butanamide |
| Molecular Weight: | 494.63 |
| Molecular Formula: | C25 H26 N4 O3 S2 |
| Smiles: | CCC(C(Nc1cccc(C#N)c1)=O)Sc1cc(C)c2cc(ccc2n1)S(N1CCCC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3419 |
| logD: | 5.3416 |
| logSw: | -5.3534 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.155 |
| InChI Key: | JWLJVVNJJIBJNS-QHCPKHFHSA-N |