AN-038/12209014
TL;DR: AN-038/12209014 (CAS 351341-36-1) is a chemical compound with molecular formula C21H24N2O2S2 and molecular weight 400.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-12,12-dimethyl-5-propylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: AN-038/12209014, 3-benzyl-6,6-dimethyl-2-(propylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one, 3-benzyl-6,6-dimethyl-2-propylsulfanyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one, 4-Benzyl-12,12-dimethyl-5-propylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one, 3-benzyl-6,6-dimethyl-2-(propylthio)-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one
| Molecular Formula | C21H24N2O2S2 |
|---|---|
| Molecular Weight | 400.13 g/mol |
| LogP | 4.8597 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.12793 |
| Heavy Atoms | 27 |
| Complexity | 1022.0779 |
Chemical Identifiers
| CAS Number | 351341-36-1 |
|---|---|
| SMILES | CCCSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1CC4=CC=CC=C4 |
Product Overview
AN-038/12209014 (CAS 351341-36-1), with molecular formula C21H24N2O2S2 and molecular weight 400.13 g/mol. IUPAC: 4-benzyl-12,12-dimethyl-5-propylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of AN-038/12209014
Property Insights of AN-038/12209014
The XLogP value of 4.8597 indicates that AN-038/12209014 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, AN-038/12209014 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-038/12209014 has 0 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 AN-038/12209014?
The CAS number of AN-038/12209014 is 351341-36-1.
What is the molecular formula of AN-038/12209014?
The molecular formula of AN-038/12209014 is C21H24N2O2S2.
What is the molecular weight of AN-038/12209014?
The molecular weight of AN-038/12209014 is 400.13 g/mol.
Where can I buy AN-038/12209014?
You can request a quote for AN-038/12209014 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-038/12209014?
Yes, KEHONG BIO provides custom synthesis services for AN-038/12209014 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.