5-methyl-11-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8,9,11-hexahydro-5aH-pyrido[2,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
5-methyl-11-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8,9,11-hexahydro-5aH-pyrido[2,1-b]quinazoline-3-carboxamide
5-methyl-11-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8,9,11-hexahydro-5aH-pyrido[2,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | S420-0302 |
| Compound Name: | 5-methyl-11-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8,9,11-hexahydro-5aH-pyrido[2,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 355.46 |
| Molecular Formula: | C19 H21 N3 O2 S |
| Smiles: | CN1C2CCCCN2C(c2ccc(cc12)C(NCc1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3955 |
| logD: | 2.3955 |
| logSw: | -3.0456 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.72 |
| InChI Key: | KSYQEDMAEFQMNL-KRWDZBQOSA-N |