C17H19N5S
TL;DR: C17H19N5S (CAS 904008-58-8) is a chemical compound with molecular formula C17H19N5S and molecular weight 325.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,12-dimethyl-10-(2-methylpropyl)-4-thiophen-2-yl-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
Also Known As: 7-isobutyl-8,9-dimethyl-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine, 8,9-dimethyl-7-(2-methylpropyl)-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C17H19N5S |
|---|---|
| Molecular Weight | 325.14 g/mol |
| LogP | 4.08034 |
| Topological Polar Surface Area | 48.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.1361 |
| Heavy Atoms | 23 |
| Complexity | 991.43604 |
Chemical Identifiers
| CAS Number | 904008-58-8 |
|---|---|
| SMILES | CC1=C(N(C2=C1C3=NC(=NN3C=N2)C4=CC=CS4)CC(C)C)C |
Product Overview
C17H19N5S (CAS 904008-58-8), with molecular formula C17H19N5S and molecular weight 325.14 g/mol. IUPAC: 11,12-dimethyl-10-(2-methylpropyl)-4-thiophen-2-yl-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene.
Chemical Property Profile of C17H19N5S
Property Insights of C17H19N5S
The XLogP value of 4.08034 indicates that C17H19N5S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.01 Ų, C17H19N5S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C17H19N5S has 0 hydrogen bond donor(s) and 4 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 C17H19N5S?
The CAS number of C17H19N5S is 904008-58-8.
What is the molecular formula of C17H19N5S?
The molecular formula of C17H19N5S is C17H19N5S.
What is the molecular weight of C17H19N5S?
The molecular weight of C17H19N5S is 325.14 g/mol.
Where can I buy C17H19N5S?
You can request a quote for C17H19N5S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H19N5S?
Yes, KEHONG BIO provides custom synthesis services for C17H19N5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.