A3770/0159920
TL;DR: A3770/0159920 (CAS 489441-19-2) is a chemical compound with molecular formula C18H18N6OS2 and molecular weight 398.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-morpholin-4-yl-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,8,13,15(20)-hexaene-6-thione
Also Known As: A3770/0159920, 11-morpholino-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3(2H)-thione, 11-(Morpholin-4-yl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3(2H)-thione, 11-(morpholin-4-yl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3-thiol, 11-MORPHOLINO-7,8,9,10-TETRAHYDRO[1,2,4]TRIAZOLO[3'',4'':6',1']PYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-3-YLHYDROSULFIDE
| Molecular Formula | C18H18N6OS2 |
|---|---|
| Molecular Weight | 398.10 g/mol |
| LogP | 3.26519 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 398.09836 |
| Heavy Atoms | 27 |
| Complexity | 1249.9137 |
Chemical Identifiers
| CAS Number | 489441-19-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N=C2N4CCOCC4)SC5=C3N=CN6C5=NNC6=S |
Product Overview
A3770/0159920 (CAS 489441-19-2), with molecular formula C18H18N6OS2 and molecular weight 398.10 g/mol. IUPAC: 14-morpholin-4-yl-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,8,13,15(20)-hexaene-6-thione.
Chemical Property Profile of A3770/0159920
Property Insights of A3770/0159920
The XLogP value of 3.26519 indicates that A3770/0159920 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for A3770/0159920. Following Lipinski's Rule of Five, A3770/0159920 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 A3770/0159920?
The CAS number of A3770/0159920 is 489441-19-2.
What is the molecular formula of A3770/0159920?
The molecular formula of A3770/0159920 is C18H18N6OS2.
What is the molecular weight of A3770/0159920?
The molecular weight of A3770/0159920 is 398.10 g/mol.
Where can I buy A3770/0159920?
You can request a quote for A3770/0159920 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3770/0159920?
Yes, KEHONG BIO provides custom synthesis services for A3770/0159920 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.