methyl 2-[(11-oxo-6,8,9,11-tetrahydro-7H-pyrido[2,1-b]quinazoline-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(11-oxo-6,8,9,11-tetrahydro-7H-pyrido[2,1-b]quinazoline-3-carbonyl)amino]benzoate
methyl 2-[(11-oxo-6,8,9,11-tetrahydro-7H-pyrido[2,1-b]quinazoline-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | E475-0047 |
| Compound Name: | methyl 2-[(11-oxo-6,8,9,11-tetrahydro-7H-pyrido[2,1-b]quinazoline-3-carbonyl)amino]benzoate |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C21 H19 N3 O4 |
| Smiles: | COC(c1ccccc1NC(c1ccc2C(N3CCCCC3=Nc2c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2088 |
| logD: | 1.6896 |
| logSw: | -3.1182 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.956 |
| InChI Key: | RIJLFGRQNJFCNL-UHFFFAOYSA-N |