AB00100819-01
TL;DR: AB00100819-01 (CAS 371951-06-3) is a chemical compound with molecular formula C18H19N3OS2 and molecular weight 357.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxyphenyl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
Also Known As: AB00100819-01, 2-[(4-methoxybenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine, 2-[(4-methoxyphenyl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine, 2-((4-methoxybenzyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-amine, 5-{[(4-METHOXYPHENYL)METHYL]SULFANYL}-8-THIA-4,6-DIAZATRICYCLO[7.4.0.0(2),?]TRIDECA-1(9),2,4,6-TETRAEN-3-AMINE
| Molecular Formula | C18H19N3OS2 |
|---|---|
| Molecular Weight | 357.10 g/mol |
| LogP | 4.4532 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.09695 |
| Heavy Atoms | 24 |
| Complexity | 874.09644 |
Chemical Identifiers
| CAS Number | 371951-06-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CSC2=NC(=C3C4=C(CCCC4)SC3=N2)N |
Product Overview
AB00100819-01 (CAS 371951-06-3), with molecular formula C18H19N3OS2 and molecular weight 357.10 g/mol. IUPAC: 2-[(4-methoxyphenyl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of AB00100819-01
Property Insights of AB00100819-01
The XLogP value of 4.4532 indicates that AB00100819-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.03 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00100819-01. Following Lipinski's Rule of Five, AB00100819-01 has 1 hydrogen bond donor(s) and 6 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 AB00100819-01?
The CAS number of AB00100819-01 is 371951-06-3.
What is the molecular formula of AB00100819-01?
The molecular formula of AB00100819-01 is C18H19N3OS2.
What is the molecular weight of AB00100819-01?
The molecular weight of AB00100819-01 is 357.10 g/mol.
Where can I buy AB00100819-01?
You can request a quote for AB00100819-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00100819-01?
Yes, KEHONG BIO provides custom synthesis services for AB00100819-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.