(E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide
TL;DR: (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide (CAS 629606-16-2) is a chemical compound with molecular formula C24H21ClN4O3S and molecular weight 480.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzenecarboximidamide
Also Known As: (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide, N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzenecarboximidamide
| Molecular Formula | C24H21ClN4O3S |
|---|---|
| Molecular Weight | 480.10 g/mol |
| LogP | 4.38542 |
| Topological Polar Surface Area | 85.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.1023 |
| Heavy Atoms | 33 |
| Complexity | 1474.7139 |
Chemical Identifiers
| CAS Number | 629606-16-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=NS(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl |
Product Overview
(E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide (CAS 629606-16-2), with molecular formula C24H21ClN4O3S and molecular weight 480.10 g/mol. IUPAC: N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzenecarboximidamide.
Chemical Property Profile of (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide
Property Insights of (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide
The XLogP value of 4.38542 indicates that (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide. Following Lipinski's Rule of Five, (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide has 1 hydrogen bond donor(s) and 3 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 (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide?
The CAS number of (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide is 629606-16-2.
What is the molecular formula of (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide?
The molecular formula of (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide is C24H21ClN4O3S.
What is the molecular weight of (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide?
The molecular weight of (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide is 480.10 g/mol.
Where can I buy (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide?
You can request a quote for (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(benzenesulfonyl)-4-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzene-1-carboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.