N-(butan-2-yl)-1-tert-butyl-4-methyl-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-1-tert-butyl-4-methyl-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-1H-pyrazole-3-carboxamide
N-(butan-2-yl)-1-tert-butyl-4-methyl-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V029-9746 |
| Compound Name: | N-(butan-2-yl)-1-tert-butyl-4-methyl-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 523.61 |
| Molecular Formula: | C23 H33 N5 O7 S |
| Salt: | not_available |
| Smiles: | CCC(C)NC(c1c(C)c(n(C(C)(C)C)n1)Oc1ccc(cc1S(N1CCOCC1)(=O)=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7496 |
| logD: | 2.7496 |
| logSw: | -3.3479 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.295 |
| InChI Key: | AHQITPUJPKBHIX-HNNXBMFYSA-N |