2-({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}methyl)quinazolin-4(3H)-one
2-({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 8016-5420 |
| Compound Name: | 2-({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}methyl)quinazolin-4(3H)-one |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C20 H17 N5 O2 S |
| Smiles: | Cc1cccc(c1)N1C(=CC(N=C1SCC1NC(c2ccccc2N=1)=O)=O)N |
| Stereo: | ACHIRAL |
| logP: | 1.786 |
| logD: | 1.7853 |
| logSw: | -2.8209 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.135 |
| InChI Key: | UKTDHZSEPFOEAX-UHFFFAOYSA-N |