A4006/0170778
TL;DR: A4006/0170778 (CAS 899370-07-1) is a chemical compound with molecular formula C24H17N5OS2 and molecular weight 455.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-benzyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanylmethyl]-2-(furan-2-yl)-1,3-thiazole
Also Known As: A4006/0170778, 4-[(5-benzyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanylmethyl]-2-(furan-2-yl)-1,3-thiazole, 4-[({5-BENZYL-5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)METHYL]-2-(FURAN-2-YL)-1,3-THIAZOLE, 5-benzyl-3-({[2-(2-furyl)-1,3-thiazol-4-yl]methyl}thio)-5H-[1,2,4]triazino[5,6-b]indole, 5-benzyl-3-({[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
| Molecular Formula | C24H17N5OS2 |
|---|---|
| Molecular Weight | 455.09 g/mol |
| LogP | 6.0366 |
| Topological Polar Surface Area | 69.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.08746 |
| Heavy Atoms | 32 |
| Complexity | 1506.102 |
Chemical Identifiers
| CAS Number | 899370-07-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2N=C(N=N4)SCC5=CSC(=N5)C6=CC=CO6 |
Product Overview
A4006/0170778 (CAS 899370-07-1), with molecular formula C24H17N5OS2 and molecular weight 455.09 g/mol. IUPAC: 4-[(5-benzyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanylmethyl]-2-(furan-2-yl)-1,3-thiazole.
Chemical Property Profile of A4006/0170778
Property Insights of A4006/0170778
The XLogP value of 6.0366 indicates that A4006/0170778 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.63 Ų falls within the moderate polarity range, balancing permeability and solubility for A4006/0170778. Following Lipinski's Rule of Five, A4006/0170778 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A4006/0170778?
The CAS number of A4006/0170778 is 899370-07-1.
What is the molecular formula of A4006/0170778?
The molecular formula of A4006/0170778 is C24H17N5OS2.
What is the molecular weight of A4006/0170778?
The molecular weight of A4006/0170778 is 455.09 g/mol.
Where can I buy A4006/0170778?
You can request a quote for A4006/0170778 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4006/0170778?
Yes, KEHONG BIO provides custom synthesis services for A4006/0170778 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.