AN-329/42607808
TL;DR: AN-329/42607808 (CAS 791792-06-8) is a chemical compound with molecular formula C18H23N5O5S2 and molecular weight 453.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]-3-methylbutanamide
Also Known As: AN-329/42607808, N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(3-methylbutanoyl)amino]carbothioyl}amino)benzenesulfonamide, 1-{4-[(2,6-DIMETHOXYPYRIMIDIN-4-YL)SULFAMOYL]PHENYL}-3-(3-METHYLBUTANOYL)THIOUREA, N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]-3-methylbutanamide, N-((4-(N-(2,6-dimethoxypyrimidin-4-yl)sulfamoyl)phenyl)carbamothioyl)-3-methylbutanamide
| Molecular Formula | C18H23N5O5S2 |
|---|---|
| Molecular Weight | 453.11 g/mol |
| LogP | 2.1537 |
| Topological Polar Surface Area | 131.54 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 453.11407 |
| Heavy Atoms | 30 |
| Complexity | 987.8772 |
Chemical Identifiers
| CAS Number | 791792-06-8 |
|---|---|
| SMILES | CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=NC(=N2)OC)OC |
Product Overview
AN-329/42607808 (CAS 791792-06-8), with molecular formula C18H23N5O5S2 and molecular weight 453.11 g/mol. IUPAC: N-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]-3-methylbutanamide.
Chemical Property Profile of AN-329/42607808
Property Insights of AN-329/42607808
The XLogP value of 2.1537 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-329/42607808. The TPSA of 131.54 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/42607808. Following Lipinski's Rule of Five, AN-329/42607808 has 3 hydrogen bond donor(s) and 8 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 AN-329/42607808?
The CAS number of AN-329/42607808 is 791792-06-8.
What is the molecular formula of AN-329/42607808?
The molecular formula of AN-329/42607808 is C18H23N5O5S2.
What is the molecular weight of AN-329/42607808?
The molecular weight of AN-329/42607808 is 453.11 g/mol.
Where can I buy AN-329/42607808?
You can request a quote for AN-329/42607808 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/42607808?
Yes, KEHONG BIO provides custom synthesis services for AN-329/42607808 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.