N-(3-chlorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
N-(3-chlorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | C243-0253 |
| Compound Name: | N-(3-chlorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 369.83 |
| Molecular Formula: | C18 H12 Cl N3 O2 S |
| Smiles: | CC1=CC=CN2C1=Nc1c(cc(C(Nc3cccc(c3)[Cl])=O)s1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 4.1021 |
| logD: | 4.0836 |
| logSw: | -4.5272 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.499 |
| InChI Key: | KLHFRMPDRGKMLG-UHFFFAOYSA-N |