6-[(4-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}phenyl)sulfanyl]-N-(prop-2-en-1-yl)pyridine-3-carboxamide
Chemical Structure Depiction of
6-[(4-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}phenyl)sulfanyl]-N-(prop-2-en-1-yl)pyridine-3-carboxamide
6-[(4-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}phenyl)sulfanyl]-N-(prop-2-en-1-yl)pyridine-3-carboxamide
Compound characteristics
Compound ID: | L612-0220 |
Compound Name: | 6-[(4-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}phenyl)sulfanyl]-N-(prop-2-en-1-yl)pyridine-3-carboxamide |
Molecular Weight: | 467.61 |
Molecular Formula: | C24 H25 N3 O3 S2 |
Smiles: | CC(C)c1ccc(cc1)S(Nc1ccc(cc1)Sc1ccc(cn1)C(NCC=C)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.2459 |
logD: | 5.2221 |
logSw: | -4.9552 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.641 |
InChI Key: | VTSHIFZQIJXIEV-UHFFFAOYSA-N |