N-(3-chloro-4-methylphenyl)-3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chloro-4-methylphenyl)-3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K821-0059 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-3-ethyl-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 361.85 |
| Molecular Formula: | C17 H16 Cl N3 O2 S |
| Smiles: | CCN1C=Nc2c(C1=O)c(C)c(C(Nc1ccc(C)c(c1)[Cl])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.7848 |
| logD: | 3.7061 |
| logSw: | -4.4657 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.329 |
| InChI Key: | XFZHPSFLLRQVHU-UHFFFAOYSA-N |