4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(3-methylbutyl)benzamide
Chemical Structure Depiction of
4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(3-methylbutyl)benzamide
4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(3-methylbutyl)benzamide
Compound characteristics
| Compound ID: | G629-0241 |
| Compound Name: | 4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(3-methylbutyl)benzamide |
| Molecular Weight: | 546.66 |
| Molecular Formula: | C30 H31 F N4 O3 S |
| Smiles: | CC(C)CCNC(c1ccc(CN2C(=Nc3ccccc3C2=O)SCC(NCc2ccc(cc2)F)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3993 |
| logD: | 4.3993 |
| logSw: | -4.1814 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.769 |
| InChI Key: | MVLKFVSSZUKJEI-UHFFFAOYSA-N |