4-chloro-N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)-3-nitrobenzamide
4-chloro-N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | V001-1254 |
| Compound Name: | 4-chloro-N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)-3-nitrobenzamide |
| Molecular Weight: | 534.01 |
| Molecular Formula: | C25 H25 Cl F N3 O5 S |
| Smiles: | COCCCN(CC(N(Cc1ccc(cc1)F)Cc1cccs1)=O)C(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7534 |
| logD: | 3.7534 |
| logSw: | -4.2096 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.553 |
| InChI Key: | SALCHIJEUFCKOZ-UHFFFAOYSA-N |