5-chloro-N-{[4-(dimethylamino)phenyl]methyl}-2-(ethylsulfanyl)-N-[(furan-2-yl)methyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-{[4-(dimethylamino)phenyl]methyl}-2-(ethylsulfanyl)-N-[(furan-2-yl)methyl]pyrimidine-4-carboxamide
5-chloro-N-{[4-(dimethylamino)phenyl]methyl}-2-(ethylsulfanyl)-N-[(furan-2-yl)methyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0342 |
| Compound Name: | 5-chloro-N-{[4-(dimethylamino)phenyl]methyl}-2-(ethylsulfanyl)-N-[(furan-2-yl)methyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 430.96 |
| Molecular Formula: | C21 H23 Cl N4 O2 S |
| Smiles: | CCSc1ncc(c(C(N(Cc2ccc(cc2)N(C)C)Cc2ccco2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4831 |
| logD: | 4.4677 |
| logSw: | -4.4101 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.317 |
| InChI Key: | YRSTWUQQXVVACK-UHFFFAOYSA-N |