methyl 4-{[1-(3-chlorobenzoyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(3-chlorobenzoyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
methyl 4-{[1-(3-chlorobenzoyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | J042-0542 |
| Compound Name: | methyl 4-{[1-(3-chlorobenzoyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate |
| Molecular Weight: | 448.91 |
| Molecular Formula: | C25 H21 Cl N2 O4 |
| Smiles: | COC(c1ccc(cc1)NC(c1ccc2c(CCCN2C(c2cccc(c2)[Cl])=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0145 |
| logD: | 4.9969 |
| logSw: | -5.1107 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.816 |
| InChI Key: | FRPUWUUNDWCABV-UHFFFAOYSA-N |