2-amino-5-[(4-nitrophenyl)sulfanyl]-6-phenyl-4-(pyridin-3-yl)-4H-pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-[(4-nitrophenyl)sulfanyl]-6-phenyl-4-(pyridin-3-yl)-4H-pyran-3-carbonitrile
2-amino-5-[(4-nitrophenyl)sulfanyl]-6-phenyl-4-(pyridin-3-yl)-4H-pyran-3-carbonitrile
Compound characteristics
Compound ID: | 8008-8146 |
Compound Name: | 2-amino-5-[(4-nitrophenyl)sulfanyl]-6-phenyl-4-(pyridin-3-yl)-4H-pyran-3-carbonitrile |
Molecular Weight: | 428.47 |
Molecular Formula: | C23 H16 N4 O3 S |
Smiles: | C(C1C(C(=C(c2ccccc2)OC=1N)Sc1ccc(cc1)[N+]([O-])=O)c1cccnc1)#N |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4926 |
logD: | 4.4926 |
logSw: | -4.4848 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 89 |
InChI Key: | UWCRWJZNXVXLFK-FQEVSTJZSA-N |