A3757/0159329
TL;DR: A3757/0159329 (CAS 573697-99-1) is a chemical compound with molecular formula C19H26N4O2S and molecular weight 374.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(dimethylamino)phenyl]-1-pentan-2-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione
Also Known As: A3757/0159329, 4-(4-(dimethylamino)phenyl)-3-hydroxy-1-(pentan-2-yl)-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one, 4-(4-dimethylaminophenyl)-1-pentan-2-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione, 4-[4-(dimethylamino)phenyl]-1-pentan-2-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione, 4-[4-(DIMETHYLAMINO)PHENYL]-3-HYDROXY-1-(PENTAN-2-YL)-1H,4H,6H,7H,8H-PYRAZOLO[3,4-E][1,4]THIAZEPIN-7-ONE
| Molecular Formula | C19H26N4O2S |
|---|---|
| Molecular Weight | 374.18 g/mol |
| LogP | 3.3782 |
| Topological Polar Surface Area | 70.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.17764 |
| Heavy Atoms | 26 |
| Complexity | 838.2143 |
Chemical Identifiers
| CAS Number | 573697-99-1 |
|---|---|
| SMILES | CCCC(C)N1C2=C(C(SCC(=O)N2)C3=CC=C(C=C3)N(C)C)C(=O)N1 |
Product Overview
A3757/0159329 (CAS 573697-99-1), with molecular formula C19H26N4O2S and molecular weight 374.18 g/mol. IUPAC: 4-[4-(dimethylamino)phenyl]-1-pentan-2-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione.
Chemical Property Profile of A3757/0159329
Property Insights of A3757/0159329
The XLogP value of 3.3782 indicates that A3757/0159329 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.13 Ų falls within the moderate polarity range, balancing permeability and solubility for A3757/0159329. Following Lipinski's Rule of Five, A3757/0159329 has 2 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 A3757/0159329?
The CAS number of A3757/0159329 is 573697-99-1.
What is the molecular formula of A3757/0159329?
The molecular formula of A3757/0159329 is C19H26N4O2S.
What is the molecular weight of A3757/0159329?
The molecular weight of A3757/0159329 is 374.18 g/mol.
Where can I buy A3757/0159329?
You can request a quote for A3757/0159329 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3757/0159329?
Yes, KEHONG BIO provides custom synthesis services for A3757/0159329 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.