AB00716859-01
TL;DR: AB00716859-01 (CAS 422563-65-3) is a chemical compound with molecular formula C15H20N4S and molecular weight 288.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-methyl-12-(4-methylpiperazin-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraene
Also Known As: AB00716859-01, F1142-2720, F1678-0201, 2-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine, 10-methyl-12-(4-methylpiperazin-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraene
| Molecular Formula | C15H20N4S |
|---|---|
| Molecular Weight | 288.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 60.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.14087 |
| Heavy Atoms | 20 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 422563-65-3 |
|---|---|
| SMILES | CC1=NC(=C2C3=C(CCC3)SC2=N1)N4CCN(CC4)C |
| InChIKey | NYQPFWREIQXJQF-UHFFFAOYSA-N |
Product Overview
AB00716859-01 (CAS 422563-65-3), with molecular formula C15H20N4S and molecular weight 288.14 g/mol. IUPAC: 10-methyl-12-(4-methylpiperazin-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraene.
Chemical Property Profile of AB00716859-01
Property Insights of AB00716859-01
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00716859-01. The TPSA of 60.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00716859-01. Following Lipinski's Rule of Five, AB00716859-01 has 0 hydrogen bond donor(s) and 5 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 AB00716859-01?
The CAS number of AB00716859-01 is 422563-65-3.
What is the molecular formula of AB00716859-01?
The molecular formula of AB00716859-01 is C15H20N4S.
What is the molecular weight of AB00716859-01?
The molecular weight of AB00716859-01 is 288.14 g/mol.
Where can I buy AB00716859-01?
You can request a quote for AB00716859-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00716859-01?
Yes, KEHONG BIO provides custom synthesis services for AB00716859-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.