D413-0082
TL;DR: D413-0082 (CAS 835911-01-8) is a chemical compound with molecular formula C25H23N5O3S and molecular weight 473.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methylbenzenesulfonamide
Also Known As: D413-0082, N-(7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methylbenzenesulfonamide, N-[7-(4-methoxyphenyl)-5-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methylbenzenesulfonamide, N-[7-(4-methoxyphenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methylbenzenesulfonamide, N-[7-(4-METHOXYPHENYL)-5-PHENYL-4H,7H-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-2-YL]-4-METHYLBENZENE-1-SULFONAMIDE
| Molecular Formula | C25H23N5O3S |
|---|---|
| Molecular Weight | 473.15 g/mol |
| LogP | 4.45192 |
| Topological Polar Surface Area | 98.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.15216 |
| Heavy Atoms | 34 |
| Complexity | 1444.9442 |
Chemical Identifiers
| CAS Number | 835911-01-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=NN3C(C=C(NC3=N2)C4=CC=CC=C4)C5=CC=C(C=C5)OC |
Product Overview
D413-0082 (CAS 835911-01-8), with molecular formula C25H23N5O3S and molecular weight 473.15 g/mol. IUPAC: N-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methylbenzenesulfonamide.
Chemical Property Profile of D413-0082
Property Insights of D413-0082
The XLogP value of 4.45192 indicates that D413-0082 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.14 Ų falls within the moderate polarity range, balancing permeability and solubility for D413-0082. Following Lipinski's Rule of Five, D413-0082 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 D413-0082?
The CAS number of D413-0082 is 835911-01-8.
What is the molecular formula of D413-0082?
The molecular formula of D413-0082 is C25H23N5O3S.
What is the molecular weight of D413-0082?
The molecular weight of D413-0082 is 473.15 g/mol.
Where can I buy D413-0082?
You can request a quote for D413-0082 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D413-0082?
Yes, KEHONG BIO provides custom synthesis services for D413-0082 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.