N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide
Chemical Structure Depiction of
N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide
N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide
Compound characteristics
| Compound ID: | V025-6279 |
| Compound Name: | N-(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide |
| Molecular Weight: | 541.61 |
| Molecular Formula: | C30 H31 N5 O5 |
| Salt: | not_available |
| Smiles: | CCCN(CC(Nc1c(c2ccccc2)c(C)nn1c1ccc(cc1)OC)=O)C(c1ccc(C)c(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9739 |
| logD: | 4.9739 |
| logSw: | -4.8305 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.02 |
| InChI Key: | FDHYXGXDXFXDHA-UHFFFAOYSA-N |