N-butyl-3-(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)propanamide
Chemical Structure Depiction of
N-butyl-3-(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)propanamide
N-butyl-3-(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)propanamide
Compound characteristics
| Compound ID: | C336-0099 |
| Compound Name: | N-butyl-3-(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)propanamide |
| Molecular Weight: | 542.06 |
| Molecular Formula: | C26 H28 Cl N5 O4 S |
| Smiles: | CCCCNC(CCC1C(N=C2c3ccccc3N=C(N12)SCC(Nc1cc(ccc1OC)[Cl])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9749 |
| logD: | 2.9726 |
| logSw: | -3.6402 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.818 |
| InChI Key: | JYMDXCJJTZVJEC-FQEVSTJZSA-N |