ChemDiv1_003734
TL;DR: ChemDiv1_003734 (CAS 6927-16-8) is a chemical compound with molecular formula C22H19ClN4O3 and molecular weight 422.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-[3-[(3-chlorophenoxy)methyl]-4-methoxyphenyl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: ChemDiv1_003734, 6-amino-4-[3-[(3-chlorophenoxy)methyl]-4-methoxyphenyl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-AMINO-4-{3-[(3-CHLOROPHENOXY)METHYL]-4-METHOXYPHENYL}-3-METHYL-2H,4H-PYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE, 6-Amino-4-{3-[(3-chlorophenoxy)methyl]-4-methoxyphenyl}-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C22H19ClN4O3 |
|---|---|
| Molecular Weight | 422.11 g/mol |
| LogP | 4.1773 |
| Topological Polar Surface Area | 106.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.11456 |
| Heavy Atoms | 30 |
| Complexity | 1179.366 |
Chemical Identifiers
| CAS Number | 6927-16-8 |
|---|---|
| SMILES | CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C=C3)OC)COC4=CC(=CC=C4)Cl |
Product Overview
ChemDiv1_003734 (CAS 6927-16-8), with molecular formula C22H19ClN4O3 and molecular weight 422.11 g/mol. IUPAC: 6-amino-4-[3-[(3-chlorophenoxy)methyl]-4-methoxyphenyl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of ChemDiv1_003734
Property Insights of ChemDiv1_003734
The XLogP value of 4.1773 indicates that ChemDiv1_003734 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.18 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003734. Following Lipinski's Rule of Five, ChemDiv1_003734 has 2 hydrogen bond donor(s) and 6 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_003734?
The CAS number of ChemDiv1_003734 is 6927-16-8.
What is the molecular formula of ChemDiv1_003734?
The molecular formula of ChemDiv1_003734 is C22H19ClN4O3.
What is the molecular weight of ChemDiv1_003734?
The molecular weight of ChemDiv1_003734 is 422.11 g/mol.
Where can I buy ChemDiv1_003734?
You can request a quote for ChemDiv1_003734 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003734?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003734 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.