BAS 07457045
TL;DR: BAS 07457045 (CAS 696607-28-0) is a chemical compound with molecular formula C18H17N5O3S and molecular weight 383.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-N-methyl-5-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Also Known As: BAS 07457045, A3598/0152427, 2-methoxy-N-methyl-5-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide, 2-methoxy-N-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide, 2-METHOXY-N-METHYL-5-{6-METHYL-[1,2,4]TRIAZOLO[3,4-A]PHTHALAZIN-3-YL}BENZENE-1-SULFONAMIDE
| Molecular Formula | C18H17N5O3S |
|---|---|
| Molecular Weight | 383.11 g/mol |
| LogP | 2.16962 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.10522 |
| Heavy Atoms | 27 |
| Complexity | 1281.1399 |
Chemical Identifiers
| CAS Number | 696607-28-0 |
|---|---|
| SMILES | CC1=NN2C(=NN=C2C3=CC=CC=C13)C4=CC(=C(C=C4)OC)S(=O)(=O)NC |
Product Overview
BAS 07457045 (CAS 696607-28-0), with molecular formula C18H17N5O3S and molecular weight 383.11 g/mol. IUPAC: 2-methoxy-N-methyl-5-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide.
Chemical Property Profile of BAS 07457045
Property Insights of BAS 07457045
The XLogP value of 2.16962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07457045. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07457045. Following Lipinski's Rule of Five, BAS 07457045 has 1 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 BAS 07457045?
The CAS number of BAS 07457045 is 696607-28-0.
What is the molecular formula of BAS 07457045?
The molecular formula of BAS 07457045 is C18H17N5O3S.
What is the molecular weight of BAS 07457045?
The molecular weight of BAS 07457045 is 383.11 g/mol.
Where can I buy BAS 07457045?
You can request a quote for BAS 07457045 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07457045?
Yes, KEHONG BIO provides custom synthesis services for BAS 07457045 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.