BAS 02729625
TL;DR: BAS 02729625 (CAS 335209-21-7) is a chemical compound with molecular formula C24H25N5O2S and molecular weight 447.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-acetylphenyl)-2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Also Known As: BAS 02729625, AB00105394-01, N-(3-acetylphenyl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide, N-(3-acetylphenyl)-2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide, N-(3-acetylphenyl)-2-({5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)butanamide
| Molecular Formula | C24H25N5O2S |
|---|---|
| Molecular Weight | 447.17 g/mol |
| LogP | 5.1015 |
| Topological Polar Surface Area | 89.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 447.17288 |
| Heavy Atoms | 32 |
| Complexity | 1300.2872 |
Chemical Identifiers
| CAS Number | 335209-21-7 |
|---|---|
| SMILES | CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SC(CC)C(=O)NC4=CC=CC(=C4)C(=O)C |
Product Overview
BAS 02729625 (CAS 335209-21-7), with molecular formula C24H25N5O2S and molecular weight 447.17 g/mol. IUPAC: N-(3-acetylphenyl)-2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide.
Chemical Property Profile of BAS 02729625
Property Insights of BAS 02729625
The XLogP value of 5.1015 indicates that BAS 02729625 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.77 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02729625. Following Lipinski's Rule of Five, BAS 02729625 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 02729625?
The CAS number of BAS 02729625 is 335209-21-7.
What is the molecular formula of BAS 02729625?
The molecular formula of BAS 02729625 is C24H25N5O2S.
What is the molecular weight of BAS 02729625?
The molecular weight of BAS 02729625 is 447.17 g/mol.
Where can I buy BAS 02729625?
You can request a quote for BAS 02729625 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02729625?
Yes, KEHONG BIO provides custom synthesis services for BAS 02729625 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.