A3666/0155415
TL;DR: A3666/0155415 (CAS 698981-16-7) is a chemical compound with molecular formula C18H22N6OS3 and molecular weight 434.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,8-bis(ethylsulfanyl)-15-propan-2-yl-16-oxa-19-thia-2,4,5,7,9,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaene
Also Known As: A3666/0155415, 3,7-bis(ethylsulfanyl)-12-(propan-2-yl)-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine, 3,7-bis(ethylsulfanyl)-12-isopropyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]di[1,2,4]triazolo[4,3-a:4,3-c]pyrimidine, 3,7-bis(ethylthio)-12-isopropyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine
| Molecular Formula | C18H22N6OS3 |
|---|---|
| Molecular Weight | 434.10 g/mol |
| LogP | 4.308 |
| Topological Polar Surface Area | 69.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.1017 |
| Heavy Atoms | 28 |
| Complexity | 1177.0472 |
Chemical Identifiers
| CAS Number | 698981-16-7 |
|---|---|
| SMILES | CCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C5=NN=C(N52)SCC |
Product Overview
A3666/0155415 (CAS 698981-16-7), with molecular formula C18H22N6OS3 and molecular weight 434.10 g/mol. IUPAC: 3,8-bis(ethylsulfanyl)-15-propan-2-yl-16-oxa-19-thia-2,4,5,7,9,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaene.
Chemical Property Profile of A3666/0155415
Property Insights of A3666/0155415
The XLogP value of 4.308 indicates that A3666/0155415 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.61 Ų falls within the moderate polarity range, balancing permeability and solubility for A3666/0155415. Following Lipinski's Rule of Five, A3666/0155415 has 0 hydrogen bond donor(s) and 8 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 A3666/0155415?
The CAS number of A3666/0155415 is 698981-16-7.
What is the molecular formula of A3666/0155415?
The molecular formula of A3666/0155415 is C18H22N6OS3.
What is the molecular weight of A3666/0155415?
The molecular weight of A3666/0155415 is 434.10 g/mol.
Where can I buy A3666/0155415?
You can request a quote for A3666/0155415 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3666/0155415?
Yes, KEHONG BIO provides custom synthesis services for A3666/0155415 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.