A3863/0164097
TL;DR: A3863/0164097 (CAS 673445-15-3) is a chemical compound with molecular formula C19H22FN3O2S and molecular weight 375.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cycloheptyl-4-(4-fluorophenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione
Also Known As: A3863/0164097, 1-cycloheptyl-4-(4-fluorophenyl)-3-hydroxy-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 1-cycloheptyl-4-(4-fluorophenyl)-7-hydroxy-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one, 1-cycloheptyl-4-(4-fluorophenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione, 1-cycloheptyl-4-(4-fluorophenyl)-3-hydroxy-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one
| Molecular Formula | C19H22FN3O2S |
|---|---|
| Molecular Weight | 375.14 g/mol |
| LogP | 3.9855 |
| Topological Polar Surface Area | 66.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.14166 |
| Heavy Atoms | 26 |
| Complexity | 850.6594 |
Chemical Identifiers
| CAS Number | 673445-15-3 |
|---|---|
| SMILES | C1CCCC(CC1)N2C3=C(C(SCC(=O)N3)C4=CC=C(C=C4)F)C(=O)N2 |
Product Overview
A3863/0164097 (CAS 673445-15-3), with molecular formula C19H22FN3O2S and molecular weight 375.14 g/mol. IUPAC: 1-cycloheptyl-4-(4-fluorophenyl)-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione.
Chemical Property Profile of A3863/0164097
Property Insights of A3863/0164097
The XLogP value of 3.9855 indicates that A3863/0164097 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.89 Ų falls within the moderate polarity range, balancing permeability and solubility for A3863/0164097. Following Lipinski's Rule of Five, A3863/0164097 has 2 hydrogen bond donor(s) and 3 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 A3863/0164097?
The CAS number of A3863/0164097 is 673445-15-3.
What is the molecular formula of A3863/0164097?
The molecular formula of A3863/0164097 is C19H22FN3O2S.
What is the molecular weight of A3863/0164097?
The molecular weight of A3863/0164097 is 375.14 g/mol.
Where can I buy A3863/0164097?
You can request a quote for A3863/0164097 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3863/0164097?
Yes, KEHONG BIO provides custom synthesis services for A3863/0164097 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.