1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-nitrophenoxy}-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-nitrophenoxy}-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-nitrophenoxy}-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V027-4480 |
| Compound Name: | 1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-nitrophenoxy}-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 546.6 |
| Molecular Formula: | C24 H30 N6 O7 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(NCc2cccnc2)=O)nn(c1Oc1ccc(cc1S(NCCOC)(=O)=O)[N+]([O-])=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 2.272 |
| logD: | 2.2718 |
| logSw: | -2.5735 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 139.694 |
| InChI Key: | TTYGYWQNNUNDRU-UHFFFAOYSA-N |