F0576-0585
TL;DR: F0576-0585 (CAS 536985-37-2) is a chemical compound with molecular formula C29H31N7OS and molecular weight 525.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-7-[4-(diethylamino)phenyl]-5-methyl-N-pyridin-3-yl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Also Known As: F0576-0585, 2-(benzylthio)-7-(4-(diethylamino)phenyl)-5-methyl-N-(pyridin-3-yl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 2-(BENZYLSULFANYL)-7-[4-(DIETHYLAMINO)PHENYL]-5-METHYL-N-(PYRIDIN-3-YL)-4H,7H-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-6-CARBOXAMIDE, 2-benzylsulfanyl-7-[4-(diethylamino)phenyl]-5-methyl-N-pyridin-3-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 2-benzylsulfanyl-7-[4-(diethylamino)phenyl]-5-methyl-N-pyridin-3-yl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
| Molecular Formula | C29H31N7OS |
|---|---|
| Molecular Weight | 525.23 g/mol |
| LogP | 5.7392 |
| Topological Polar Surface Area | 87.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 525.2311 |
| Heavy Atoms | 38 |
| Complexity | 1414.5842 |
Chemical Identifiers
| CAS Number | 536985-37-2 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2C(=C(NC3=NC(=NN23)SCC4=CC=CC=C4)C)C(=O)NC5=CN=CC=C5 |
Product Overview
F0576-0585 (CAS 536985-37-2), with molecular formula C29H31N7OS and molecular weight 525.23 g/mol. IUPAC: 2-benzylsulfanyl-7-[4-(diethylamino)phenyl]-5-methyl-N-pyridin-3-yl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.
Chemical Property Profile of F0576-0585
Property Insights of F0576-0585
The XLogP value of 5.7392 indicates that F0576-0585 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.97 Ų falls within the moderate polarity range, balancing permeability and solubility for F0576-0585. Following Lipinski's Rule of Five, F0576-0585 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0576-0585?
The CAS number of F0576-0585 is 536985-37-2.
What is the molecular formula of F0576-0585?
The molecular formula of F0576-0585 is C29H31N7OS.
What is the molecular weight of F0576-0585?
The molecular weight of F0576-0585 is 525.23 g/mol.
Where can I buy F0576-0585?
You can request a quote for F0576-0585 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0576-0585?
Yes, KEHONG BIO provides custom synthesis services for F0576-0585 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.