![N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE structure](/static/products/899/899407-08-0.png)
N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE
TL;DR: N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE (CAS 899407-08-0) is a chemical compound with molecular formula C18H16N6OS and molecular weight 364.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(pyridin-3-ylmethyl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide
Also Known As: N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE, N-(pyridin-3-ylmethyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide, N-(pyridin-3-ylmethyl)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
| Molecular Formula | C18H16N6OS |
|---|---|
| Molecular Weight | 364.11 g/mol |
| LogP | 2.5428 |
| Topological Polar Surface Area | 85.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.11063 |
| Heavy Atoms | 26 |
| Complexity | 1117.0792 |
Chemical Identifiers
| CAS Number | 899407-08-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=CN4C3=NC(=N4)C(=O)NCC5=CN=CC=C5 |
Product Overview
N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE (CAS 899407-08-0), with molecular formula C18H16N6OS and molecular weight 364.11 g/mol. IUPAC: N-(pyridin-3-ylmethyl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide.
Chemical Property Profile of N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE
Property Insights of N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE
The XLogP value of 2.5428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE. The TPSA of 85.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE. Following Lipinski's Rule of Five, N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE has 1 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 N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE?
The CAS number of N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE is 899407-08-0.
What is the molecular formula of N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE?
The molecular formula of N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE is C18H16N6OS.
What is the molecular weight of N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE?
The molecular weight of N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE is 364.11 g/mol.
Where can I buy N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE?
You can request a quote for N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE?
Yes, KEHONG BIO provides custom synthesis services for N-(3-PYRIDINYLMETHYL)-8,9,10,11-TETRAHYDRO[1]BENZOTHIENO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-CARBOXAMIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.