4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-propylbenzamide
Chemical Structure Depiction of
4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-propylbenzamide
4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-propylbenzamide
Compound characteristics
| Compound ID: | G629-0051 |
| Compound Name: | 4-({2-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-propylbenzamide |
| Molecular Weight: | 518.61 |
| Molecular Formula: | C28 H27 F N4 O3 S |
| Smiles: | CCCNC(c1ccc(CN2C(=Nc3ccccc3C2=O)SCC(NCc2ccc(cc2)F)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5986 |
| logD: | 3.5986 |
| logSw: | -3.8103 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.769 |
| InChI Key: | NSHMBGGKNGELHM-UHFFFAOYSA-N |