AB00726844-01
TL;DR: AB00726844-01 (CAS 602293-26-5) is a chemical compound with molecular formula C16H19N3O2S and molecular weight 317.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid
Also Known As: AB00726844-01, 1-(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid, 1-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid, 1-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid
| Molecular Formula | C16H19N3O2S |
|---|---|
| Molecular Weight | 317.12 g/mol |
| LogP | 2.8711 |
| Topological Polar Surface Area | 66.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.1198 |
| Heavy Atoms | 22 |
| Complexity | 719.4944 |
Chemical Identifiers
| CAS Number | 602293-26-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N=CN=C3S2)N4CCC(CC4)C(=O)O |
Product Overview
AB00726844-01 (CAS 602293-26-5), with molecular formula C16H19N3O2S and molecular weight 317.12 g/mol. IUPAC: 1-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid.
Chemical Property Profile of AB00726844-01
Property Insights of AB00726844-01
The XLogP value of 2.8711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00726844-01. The TPSA of 66.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00726844-01. Following Lipinski's Rule of Five, AB00726844-01 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 AB00726844-01?
The CAS number of AB00726844-01 is 602293-26-5.
What is the molecular formula of AB00726844-01?
The molecular formula of AB00726844-01 is C16H19N3O2S.
What is the molecular weight of AB00726844-01?
The molecular weight of AB00726844-01 is 317.12 g/mol.
Where can I buy AB00726844-01?
You can request a quote for AB00726844-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00726844-01?
Yes, KEHONG BIO provides custom synthesis services for AB00726844-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.