BAS 02729536
TL;DR: BAS 02729536 (CAS 309280-72-6) is a chemical compound with molecular formula C19H19N5O2S and molecular weight 381.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Also Known As: BAS 02729536, A2094/0087997, N-(furan-2-ylmethyl)-2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide, N-(2-furylmethyl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide, N-(2-furylmethyl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetamide
| Molecular Formula | C19H19N5O2S |
|---|---|
| Molecular Weight | 381.13 g/mol |
| LogP | 3.391 |
| Topological Polar Surface Area | 85.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.12595 |
| Heavy Atoms | 27 |
| Complexity | 1074.5414 |
Chemical Identifiers
| CAS Number | 309280-72-6 |
|---|---|
| SMILES | CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NCC4=CC=CO4 |
Product Overview
BAS 02729536 (CAS 309280-72-6), with molecular formula C19H19N5O2S and molecular weight 381.13 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 02729536
Property Insights of BAS 02729536
The XLogP value of 3.391 indicates that BAS 02729536 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02729536. Following Lipinski's Rule of Five, BAS 02729536 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 02729536?
The CAS number of BAS 02729536 is 309280-72-6.
What is the molecular formula of BAS 02729536?
The molecular formula of BAS 02729536 is C19H19N5O2S.
What is the molecular weight of BAS 02729536?
The molecular weight of BAS 02729536 is 381.13 g/mol.
Where can I buy BAS 02729536?
You can request a quote for BAS 02729536 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02729536?
Yes, KEHONG BIO provides custom synthesis services for BAS 02729536 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.