4-[2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
Chemical Structure Depiction of
4-[2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
4-[2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
Compound characteristics
| Compound ID: | K284-4624 |
| Compound Name: | 4-[2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide |
| Molecular Weight: | 550.68 |
| Molecular Formula: | C29 H34 N4 O5 S |
| Smiles: | CC(c1ccc(c(CSC2=Nc3ccccc3C(N2CCCC(NCCCN2CCCC2=O)=O)=O)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0023 |
| logD: | 1.0023 |
| logSw: | -2.3663 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.032 |
| InChI Key: | SEFPDFZKYRQUQD-UHFFFAOYSA-N |