AN-512/12674243
TL;DR: AN-512/12674243 (CAS 353762-99-9) is a chemical compound with molecular formula C23H26N2O3S2 and molecular weight 442.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Also Known As: AN-512/12674243, pentyl [(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate, pentyl 2-((4-oxo-3-phenyl-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate, pentyl 2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
| Molecular Formula | C23H26N2O3S2 |
|---|---|
| Molecular Weight | 442.14 g/mol |
| LogP | 5.1515 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 442.1385 |
| Heavy Atoms | 30 |
| Complexity | 1089.2616 |
Chemical Identifiers
| CAS Number | 353762-99-9 |
|---|---|
| SMILES | CCCCCOC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=CC=C4 |
Product Overview
AN-512/12674243 (CAS 353762-99-9), with molecular formula C23H26N2O3S2 and molecular weight 442.14 g/mol. IUPAC: pentyl 2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetate.
Chemical Property Profile of AN-512/12674243
Property Insights of AN-512/12674243
The XLogP value of 5.1515 indicates that AN-512/12674243 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-512/12674243. Following Lipinski's Rule of Five, AN-512/12674243 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-512/12674243?
The CAS number of AN-512/12674243 is 353762-99-9.
What is the molecular formula of AN-512/12674243?
The molecular formula of AN-512/12674243 is C23H26N2O3S2.
What is the molecular weight of AN-512/12674243?
The molecular weight of AN-512/12674243 is 442.14 g/mol.
Where can I buy AN-512/12674243?
You can request a quote for AN-512/12674243 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-512/12674243?
Yes, KEHONG BIO provides custom synthesis services for AN-512/12674243 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.