N-cyclohexyl-3-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}propanamide
Chemical Structure Depiction of
N-cyclohexyl-3-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}propanamide
N-cyclohexyl-3-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}propanamide
Compound characteristics
| Compound ID: | K284-3032 |
| Compound Name: | N-cyclohexyl-3-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}propanamide |
| Molecular Weight: | 552.69 |
| Molecular Formula: | C29 H36 N4 O5 S |
| Smiles: | COc1ccc(CCNC(CSC2=Nc3ccccc3C(N2CCC(NC2CCCCC2)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6256 |
| logD: | 2.6256 |
| logSw: | -3.3311 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.52 |
| InChI Key: | NDEGLPZRZHZPPV-UHFFFAOYSA-N |