ethyl 3-[(11-imino-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 3-[(11-imino-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carbonyl)amino]benzoate
ethyl 3-[(11-imino-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | C490-0252 |
| Compound Name: | ethyl 3-[(11-imino-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carbonyl)amino]benzoate |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C25 H25 N3 O4 |
| Smiles: | CCOC(c1cccc(c1)NC(C1=Cc2cc3CCCN4CCCc(c34)c2OC1=N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1833 |
| logD: | 4.1817 |
| logSw: | -4.3111 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.888 |
| InChI Key: | JCGZMFVYVOXEOF-UHFFFAOYSA-N |