3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-(2-phenylethyl)propanamide
3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-(2-phenylethyl)propanamide
Compound characteristics
| Compound ID: | K284-3745 |
| Compound Name: | 3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-(2-phenylethyl)propanamide |
| Molecular Weight: | 518.68 |
| Molecular Formula: | C29 H34 N4 O3 S |
| Smiles: | C1CCC(CCNC(CSC2=Nc3ccccc3C(N2CCC(NCCc2ccccc2)=O)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.9094 |
| logD: | 2.9094 |
| logSw: | -3.7136 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.567 |
| InChI Key: | WHAOXQSTQAJKNA-UHFFFAOYSA-N |