4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-3556 |
| Compound Name: | 4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C27 H32 N4 O4 S |
| Smiles: | C1CCC(CCNC(CSC2=Nc3ccccc3C(N2CCCC(NCc2ccco2)=O)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.6321 |
| logD: | 2.6321 |
| logSw: | -3.3386 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.475 |
| InChI Key: | UZEGFCVKGRKVQJ-UHFFFAOYSA-N |