ethyl 2-({[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate
Chemical Structure Depiction of
ethyl 2-({[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate
ethyl 2-({[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate
Compound characteristics
| Compound ID: | G760-0116 |
| Compound Name: | ethyl 2-({[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C25 H25 N5 O3 |
| Smiles: | CCOC(c1ccccc1NC(NCc1c(C)nn(c2ccccc2)c1n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5843 |
| logD: | 4.5832 |
| logSw: | -4.4165 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.129 |
| InChI Key: | YGIMJZMCFWMGBY-UHFFFAOYSA-N |