N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)quinazoline-6-carboxamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)quinazoline-6-carboxamide
N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)quinazoline-6-carboxamide
Compound characteristics
| Compound ID: | M628-0207 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)quinazoline-6-carboxamide |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C21 H22 N4 O S |
| Smiles: | CSc1ccc(CNC(c2ccc3c(c2)c(ncn3)N2CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2134 |
| logD: | 4.213 |
| logSw: | -4.1707 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.928 |
| InChI Key: | MONRMTIUYQLGIK-UHFFFAOYSA-N |