3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol
TL;DR: 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol (CAS 862117-10-0) is a chemical compound with molecular formula C14H17N5OS and molecular weight 303.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-ylamino)propan-1-ol
Also Known As: 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol, 3-(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ylamino)-1-propanol, 3-(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ylamino)propan-1-ol
| Molecular Formula | C14H17N5OS |
|---|---|
| Molecular Weight | 303.12 g/mol |
| LogP | 2.0121 |
| Topological Polar Surface Area | 75.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.1154 |
| Heavy Atoms | 21 |
| Complexity | 793.4554 |
Chemical Identifiers
| CAS Number | 862117-10-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(N4C3=NC=N4)NCCCO |
Product Overview
3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol (CAS 862117-10-0), with molecular formula C14H17N5OS and molecular weight 303.12 g/mol. IUPAC: 3-(10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-ylamino)propan-1-ol.
Chemical Property Profile of 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol
Property Insights of 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol
The XLogP value of 2.0121 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol. The TPSA of 75.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol. Following Lipinski's Rule of Five, 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol has 2 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 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol?
The CAS number of 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol is 862117-10-0.
What is the molecular formula of 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol?
The molecular formula of 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol is C14H17N5OS.
What is the molecular weight of 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol?
The molecular weight of 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol is 303.12 g/mol.
Where can I buy 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol?
You can request a quote for 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.