3-bromo-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
3-bromo-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
3-bromo-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V007-3489 |
| Compound Name: | 3-bromo-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 515.44 |
| Molecular Formula: | C25 H24 Br F N2 O2 S |
| Smiles: | Cc1ccc(CN(Cc2ccc(cc2)F)C(CN(CC=C)C(c2cccc(c2)[Br])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.2402 |
| logD: | 5.2402 |
| logSw: | -5.1507 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.13 |
| InChI Key: | KPOCWFJVQBUNPW-UHFFFAOYSA-N |