N-(3-chloro-4-fluorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
N-(3-chloro-4-fluorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | C243-0316 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 387.82 |
| Molecular Formula: | C18 H11 Cl F N3 O2 S |
| Smiles: | CC1=CC=CN2C1=Nc1c(cc(C(Nc3ccc(c(c3)[Cl])F)=O)s1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 4.0787 |
| logD: | 3.5076 |
| logSw: | -4.5259 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.499 |
| InChI Key: | LULZHPOCRSVNHH-UHFFFAOYSA-N |