2-[5-(2-chlorophenyl)furan-2-yl]-4-oxo-1-phenyl-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-[5-(2-chlorophenyl)furan-2-yl]-4-oxo-1-phenyl-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
2-[5-(2-chlorophenyl)furan-2-yl]-4-oxo-1-phenyl-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8014-5602 |
| Compound Name: | 2-[5-(2-chlorophenyl)furan-2-yl]-4-oxo-1-phenyl-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile |
| Molecular Weight: | 407.88 |
| Molecular Formula: | C21 H14 Cl N3 O2 S |
| Smiles: | C(C1=C(N(C(c2ccc(c3ccccc3[Cl])o2)NC1=O)c1ccccc1)S)#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3585 |
| logD: | 0.5169 |
| logSw: | -4.6136 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.774 |
| InChI Key: | DFCXUASQWBOJMQ-IBGZPJMESA-N |