![(5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide structure](/static/products/879/879446-42-1.png)
(5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide
TL;DR: (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide (CAS 879446-42-1) is a chemical compound with molecular formula C22H24N4O5S and molecular weight 456.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-3-(2-hydroxyphenyl)-1H-pyrazole-5-carboxamide
Also Known As: (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide, (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide, (5E)-N-[4-(2,6-dimethylmorpholino)sulfonylphenyl]-5-(6-ketocyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carboxamide, (5E)-N-[4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]phenyl]-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazole-3-carboxamide, (5Z)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide
| Molecular Formula | C22H24N4O5S |
|---|---|
| Molecular Weight | 456.15 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.14673 |
| Heavy Atoms | 32 |
| Complexity | 742.0 |
Chemical Identifiers
| CAS Number | 879446-42-1 |
|---|---|
| SMILES | CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4O |
| InChIKey | NBKLJDOWJLNSOU-UHFFFAOYSA-N |
Product Overview
(5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide (CAS 879446-42-1), with molecular formula C22H24N4O5S and molecular weight 456.15 g/mol. IUPAC: N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-3-(2-hydroxyphenyl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide
Property Insights of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide. Following Lipinski's Rule of Five, (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide?
The CAS number of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide is 879446-42-1.
What is the molecular formula of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide?
The molecular formula of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide is C22H24N4O5S.
What is the molecular weight of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide?
The molecular weight of (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide is 456.15 g/mol.
Where can I buy (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide?
You can request a quote for (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (5E)-N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.