AB00686360-01
TL;DR: AB00686360-01 (CAS 867136-49-0) is a chemical compound with molecular formula C23H15N5O2S and molecular weight 425.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzothiazol-2-yl)-7-(furan-2-ylmethyl)-6-imino-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: AB00686360-01, F1673-1828, AS-871/42864471, 5-(1,3-benzothiazol-2-yl)-7-[(furan-2-yl)methyl]-6-imino-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaen-2-one, 3-(1,3-benzothiazol-2-yl)-1-(2-furylmethyl)-2-imino-1,2-dihydro-5H-dipyrido[1,2-a:2,3-d]pyrimidin-5-one
| Molecular Formula | C23H15N5O2S |
|---|---|
| Molecular Weight | 425.09 g/mol |
| LogP | 4.04667 |
| Topological Polar Surface Area | 89.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 425.09464 |
| Heavy Atoms | 31 |
| Complexity | 1677.1038 |
Chemical Identifiers
| CAS Number | 867136-49-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(N=C5C=CC=CN5C4=O)N(C3=N)CC6=CC=CO6 |
Product Overview
AB00686360-01 (CAS 867136-49-0), with molecular formula C23H15N5O2S and molecular weight 425.09 g/mol. IUPAC: 5-(1,3-benzothiazol-2-yl)-7-(furan-2-ylmethyl)-6-imino-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.
Chemical Property Profile of AB00686360-01
Property Insights of AB00686360-01
The XLogP value of 4.04667 indicates that AB00686360-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.18 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00686360-01. Following Lipinski's Rule of Five, AB00686360-01 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 AB00686360-01?
The CAS number of AB00686360-01 is 867136-49-0.
What is the molecular formula of AB00686360-01?
The molecular formula of AB00686360-01 is C23H15N5O2S.
What is the molecular weight of AB00686360-01?
The molecular weight of AB00686360-01 is 425.09 g/mol.
Where can I buy AB00686360-01?
You can request a quote for AB00686360-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00686360-01?
Yes, KEHONG BIO provides custom synthesis services for AB00686360-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.