N-(4-butoxyphenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(4-butoxyphenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
N-(4-butoxyphenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | C243-0098 |
| Compound Name: | N-(4-butoxyphenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C21 H19 N3 O3 S |
| Smiles: | CCCCOc1ccc(cc1)NC(c1cc2C(N3C=CC=CC3=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5105 |
| logD: | 4.51 |
| logSw: | -4.3025 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.896 |
| InChI Key: | FXDYWKXXOJNNKB-UHFFFAOYSA-N |