methyl 4-({10-[(4-methylphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-ylidene}amino)benzoate
Chemical Structure Depiction of
methyl 4-({10-[(4-methylphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-ylidene}amino)benzoate
methyl 4-({10-[(4-methylphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-ylidene}amino)benzoate
Compound characteristics
| Compound ID: | C490-0167 |
| Compound Name: | methyl 4-({10-[(4-methylphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-ylidene}amino)benzoate |
| Molecular Weight: | 507.59 |
| Molecular Formula: | C31 H29 N3 O4 |
| Smiles: | Cc1ccc(cc1)NC(C1=Cc2cc3CCCN4CCCc(c34)c2OC/1=N/c1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6054 |
| logD: | 5.6049 |
| logSw: | -5.3736 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.777 |
| InChI Key: | NJIVPOXHDTWEKI-UHFFFAOYSA-N |