BAS 05968730
TL;DR: BAS 05968730 (CAS 522651-24-7) is a chemical compound with molecular formula C23H25N5O2S and molecular weight 435.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyphenyl)-2-[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Also Known As: BAS 05968730, N-(2-methoxyphenyl)-2-[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide, N-(2-methoxyphenyl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}butanamide, 2-({5-ISOPROPYL-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)-N-(2-METHOXYPHENYL)BUTANAMIDE, 2-[(5-ISOPROPYL-5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL)SULFANYL]-N~1~-(2-METHOXYPHENYL)BUTANAMIDE
| Molecular Formula | C23H25N5O2S |
|---|---|
| Molecular Weight | 435.17 g/mol |
| LogP | 5.0784 |
| Topological Polar Surface Area | 81.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 435.17288 |
| Heavy Atoms | 31 |
| Complexity | 1237.3326 |
Chemical Identifiers
| CAS Number | 522651-24-7 |
|---|---|
| SMILES | CCC(C(=O)NC1=CC=CC=C1OC)SC2=NC3=C(C4=CC=CC=C4N3C(C)C)N=N2 |
Product Overview
BAS 05968730 (CAS 522651-24-7), with molecular formula C23H25N5O2S and molecular weight 435.17 g/mol. IUPAC: N-(2-methoxyphenyl)-2-[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide.
Chemical Property Profile of BAS 05968730
Property Insights of BAS 05968730
The XLogP value of 5.0784 indicates that BAS 05968730 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05968730. Following Lipinski's Rule of Five, BAS 05968730 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 05968730?
The CAS number of BAS 05968730 is 522651-24-7.
What is the molecular formula of BAS 05968730?
The molecular formula of BAS 05968730 is C23H25N5O2S.
What is the molecular weight of BAS 05968730?
The molecular weight of BAS 05968730 is 435.17 g/mol.
Where can I buy BAS 05968730?
You can request a quote for BAS 05968730 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05968730?
Yes, KEHONG BIO provides custom synthesis services for BAS 05968730 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.