4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-3544 |
| Compound Name: | 4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide |
| Molecular Weight: | 564.66 |
| Molecular Formula: | C29 H32 N4 O6 S |
| Smiles: | COc1ccc(CCNC(CSC2=Nc3ccccc3C(N2CCCC(NCc2ccco2)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.7787 |
| logD: | 1.7787 |
| logSw: | -2.6877 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.544 |
| InChI Key: | RXXPWVMWMIEAPO-UHFFFAOYSA-N |