ChemDiv1_014942
TL;DR: ChemDiv1_014942 (CAS 403731-99-7) is a chemical compound with molecular formula C25H23N5O4 and molecular weight 457.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[6-amino-5-cyano-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl] morpholine-4-carboxylate
Also Known As: ChemDiv1_014942, DivK1c_003246, CDS1_002206, F0912-4068, [4-[6-amino-5-cyano-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl] morpholine-4-carboxylate
| Molecular Formula | C25H23N5O4 |
|---|---|
| Molecular Weight | 457.18 g/mol |
| LogP | 3.4343 |
| Topological Polar Surface Area | 126.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 457.17502 |
| Heavy Atoms | 34 |
| Complexity | 1282.3353 |
Chemical Identifiers
| CAS Number | 403731-99-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)OC(=O)N5CCOCC5 |
Product Overview
ChemDiv1_014942 (CAS 403731-99-7), with molecular formula C25H23N5O4 and molecular weight 457.18 g/mol. IUPAC: [4-[6-amino-5-cyano-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl] morpholine-4-carboxylate.
Chemical Property Profile of ChemDiv1_014942
Property Insights of ChemDiv1_014942
The XLogP value of 3.4343 indicates that ChemDiv1_014942 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.49 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014942. Following Lipinski's Rule of Five, ChemDiv1_014942 has 2 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 ChemDiv1_014942?
The CAS number of ChemDiv1_014942 is 403731-99-7.
What is the molecular formula of ChemDiv1_014942?
The molecular formula of ChemDiv1_014942 is C25H23N5O4.
What is the molecular weight of ChemDiv1_014942?
The molecular weight of ChemDiv1_014942 is 457.18 g/mol.
Where can I buy ChemDiv1_014942?
You can request a quote for ChemDiv1_014942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014942?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.