AN-512/12673301
TL;DR: AN-512/12673301 (CAS 351007-37-9) is a chemical compound with molecular formula C18H24N2OS2 and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butylsulfanyl-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: AN-512/12673301, 2-butylsulfanyl-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 2-(butylsulfanyl)-3-(2-methyl-2-propenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-(BUTYLSULFANYL)-3-(2-METHYL-2-PROPEN-1-YL)-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE, 2-(butylsulfanyl)-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C18H24N2OS2 |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 4.8051 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 348.133 |
| Heavy Atoms | 23 |
| Complexity | 788.396 |
Chemical Identifiers
| CAS Number | 351007-37-9 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC(=C)C |
Product Overview
AN-512/12673301 (CAS 351007-37-9), with molecular formula C18H24N2OS2 and molecular weight 348.13 g/mol. IUPAC: 2-butylsulfanyl-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AN-512/12673301
Property Insights of AN-512/12673301
The XLogP value of 4.8051 indicates that AN-512/12673301 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, AN-512/12673301 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-512/12673301 has 0 hydrogen bond donor(s) and 4 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 AN-512/12673301?
The CAS number of AN-512/12673301 is 351007-37-9.
What is the molecular formula of AN-512/12673301?
The molecular formula of AN-512/12673301 is C18H24N2OS2.
What is the molecular weight of AN-512/12673301?
The molecular weight of AN-512/12673301 is 348.13 g/mol.
Where can I buy AN-512/12673301?
You can request a quote for AN-512/12673301 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-512/12673301?
Yes, KEHONG BIO provides custom synthesis services for AN-512/12673301 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.