6-oxo-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4-phenyl-1,6-dihydropyrimidine-5-carbonitrile
Chemical Structure Depiction of
6-oxo-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4-phenyl-1,6-dihydropyrimidine-5-carbonitrile
6-oxo-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4-phenyl-1,6-dihydropyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8016-2586 |
| Compound Name: | 6-oxo-2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4-phenyl-1,6-dihydropyrimidine-5-carbonitrile |
| Molecular Weight: | 387.42 |
| Molecular Formula: | C20 H13 N5 O2 S |
| Smiles: | C(C1NC(c2ccccc2N=1)=O)SC1NC(C(C#N)=C(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.012 |
| logD: | -1.7041 |
| logSw: | -2.9209 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.372 |
| InChI Key: | RAZRPTFMWSUQPP-UHFFFAOYSA-N |