4-(5-bromothiophen-2-yl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
4-(5-bromothiophen-2-yl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dihydro-2H-1,5-benzodiazepin-2-one
4-(5-bromothiophen-2-yl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | F402-0273 |
| Compound Name: | 4-(5-bromothiophen-2-yl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dihydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 541.44 |
| Molecular Formula: | C25 H22 Br F N4 O2 S |
| Smiles: | C1C(c2ccc(s2)[Br])=Nc2ccccc2N(CC(N2CCN(CC2)c2ccc(cc2)F)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.4755 |
| logD: | 4.4754 |
| logSw: | -4.3034 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.261 |
| InChI Key: | HHHBKCYUAWFIND-UHFFFAOYSA-N |