AN-212/13751002
TL;DR: AN-212/13751002 (CAS 303088-97-3) is a chemical compound with molecular formula C20H19N5O2S3 and molecular weight 457.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(12,12-dimethyl-8-oxo-7-phenyl-13,16-dithia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl)sulfanyl]acetamide
Also Known As: AN-212/13751002, 2-[(7,7-dimethyl-5-oxo-4-phenyl-4,5,6,9-tetrahydro-7H-thiopyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide, 2-((7,7-dimethyl-5-oxo-4-phenyl-5,6,7,9-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)acetamide
| Molecular Formula | C20H19N5O2S3 |
|---|---|
| Molecular Weight | 457.07 g/mol |
| LogP | 3.2402 |
| Topological Polar Surface Area | 95.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 457.0701 |
| Heavy Atoms | 30 |
| Complexity | 1354.0332 |
Chemical Identifiers
| CAS Number | 303088-97-3 |
|---|---|
| SMILES | CC1(CC2=C(CS1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)N)C5=CC=CC=C5)C |
Product Overview
AN-212/13751002 (CAS 303088-97-3), with molecular formula C20H19N5O2S3 and molecular weight 457.07 g/mol. IUPAC: 2-[(12,12-dimethyl-8-oxo-7-phenyl-13,16-dithia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl)sulfanyl]acetamide.
Chemical Property Profile of AN-212/13751002
Property Insights of AN-212/13751002
The XLogP value of 3.2402 indicates that AN-212/13751002 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.28 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-212/13751002. Following Lipinski's Rule of Five, AN-212/13751002 has 1 hydrogen bond donor(s) and 7 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-212/13751002?
The CAS number of AN-212/13751002 is 303088-97-3.
What is the molecular formula of AN-212/13751002?
The molecular formula of AN-212/13751002 is C20H19N5O2S3.
What is the molecular weight of AN-212/13751002?
The molecular weight of AN-212/13751002 is 457.07 g/mol.
Where can I buy AN-212/13751002?
You can request a quote for AN-212/13751002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-212/13751002?
Yes, KEHONG BIO provides custom synthesis services for AN-212/13751002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.