AB00101210-01
TL;DR: AB00101210-01 (CAS 353460-97-6) is a chemical compound with molecular formula C17H14ClN3O2S2 and molecular weight 391.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[11-(4-chlorophenyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide
Also Known As: AB00101210-01, 2-{[3-(4-chlorophenyl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide, 2-((3-(4-chlorophenyl)-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide, 2-[3-(4-chlorophenyl)-4-oxo-3,5,6,7-tetrahydrocyclopenta[2,1-d]pyrimidino[4,5- b]thiophen-2-ylthio]acetamide, 2-{[11-(4-chlorophenyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl}acetamide
| Molecular Formula | C17H14ClN3O2S2 |
|---|---|
| Molecular Weight | 391.02 g/mol |
| LogP | 3.1667 |
| Topological Polar Surface Area | 77.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.0216 |
| Heavy Atoms | 25 |
| Complexity | 1040.713 |
Chemical Identifiers
| CAS Number | 353460-97-6 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)N)C4=CC=C(C=C4)Cl |
Product Overview
AB00101210-01 (CAS 353460-97-6), with molecular formula C17H14ClN3O2S2 and molecular weight 391.02 g/mol. IUPAC: 2-[[11-(4-chlorophenyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00101210-01
Property Insights of AB00101210-01
The XLogP value of 3.1667 indicates that AB00101210-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.98 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00101210-01. Following Lipinski's Rule of Five, AB00101210-01 has 1 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 AB00101210-01?
The CAS number of AB00101210-01 is 353460-97-6.
What is the molecular formula of AB00101210-01?
The molecular formula of AB00101210-01 is C17H14ClN3O2S2.
What is the molecular weight of AB00101210-01?
The molecular weight of AB00101210-01 is 391.02 g/mol.
Where can I buy AB00101210-01?
You can request a quote for AB00101210-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00101210-01?
Yes, KEHONG BIO provides custom synthesis services for AB00101210-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.