N-butyl-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-butyl-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
N-butyl-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | V028-6412 |
| Compound Name: | N-butyl-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 367.41 |
| Molecular Formula: | C19 H21 N5 O3 |
| Salt: | not_available |
| Smiles: | CCCCNC(c1cc(c2cccn2C)nn1c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2665 |
| logD: | 4.2665 |
| logSw: | -4.2111 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.386 |
| InChI Key: | WTPFYFCORRCCPA-UHFFFAOYSA-N |