ChemDiv1_014618
TL;DR: ChemDiv1_014618 (CAS 450344-52-2) is a chemical compound with molecular formula C25H28N4O3S2 and molecular weight 496.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2,3-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-piperidin-1-ylsulfonylbenzamide
Also Known As: ChemDiv1_014618, F0541-1569, N-(2-(2,3-dimethylphenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-(piperidin-1-ylsulfonyl)benzamide, N-[2-(2,3-dimethylphenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-4-(piperidine-1-sulfonyl)benzamide, N-[2-(2,3-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-piperidin-1-ylsulfonylbenzamide
| Molecular Formula | C25H28N4O3S2 |
|---|---|
| Molecular Weight | 496.16 g/mol |
| LogP | 4.66284 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.16028 |
| Heavy Atoms | 34 |
| Complexity | 1341.2255 |
Chemical Identifiers
| CAS Number | 450344-52-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2C(=C3CSCC3=N2)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)C |
Product Overview
ChemDiv1_014618 (CAS 450344-52-2), with molecular formula C25H28N4O3S2 and molecular weight 496.16 g/mol. IUPAC: N-[2-(2,3-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-piperidin-1-ylsulfonylbenzamide.
Chemical Property Profile of ChemDiv1_014618
Property Insights of ChemDiv1_014618
The XLogP value of 4.66284 indicates that ChemDiv1_014618 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014618. Following Lipinski's Rule of Five, ChemDiv1_014618 has 1 hydrogen bond donor(s) and 5 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 ChemDiv1_014618?
The CAS number of ChemDiv1_014618 is 450344-52-2.
What is the molecular formula of ChemDiv1_014618?
The molecular formula of ChemDiv1_014618 is C25H28N4O3S2.
What is the molecular weight of ChemDiv1_014618?
The molecular weight of ChemDiv1_014618 is 496.16 g/mol.
Where can I buy ChemDiv1_014618?
You can request a quote for ChemDiv1_014618 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014618?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014618 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.