ChemDiv1_017223
TL;DR: ChemDiv1_017223 (CAS 434291-17-5) is a chemical compound with molecular formula C22H18N2O2S and molecular weight 374.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-amino-8-(furan-2-yl)-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7-tetraen-5-yl]-(4-methylphenyl)methanone
Also Known As: ChemDiv1_017223, (3-amino-4-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridin-2-yl)(p-tolyl)methanone, [3-amino-4-(2-furyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridin-2-yl](4-methylphenyl)methanone, [3-amino-4-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridin-2-yl](4-methylphenyl)methanone
| Molecular Formula | C22H18N2O2S |
|---|---|
| Molecular Weight | 374.11 g/mol |
| LogP | 5.16662 |
| Topological Polar Surface Area | 69.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.1089 |
| Heavy Atoms | 27 |
| Complexity | 1171.7225 |
Chemical Identifiers
| CAS Number | 434291-17-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C2=C(C3=C(C4=C(CCC4)N=C3S2)C5=CC=CO5)N |
Product Overview
ChemDiv1_017223 (CAS 434291-17-5), with molecular formula C22H18N2O2S and molecular weight 374.11 g/mol. IUPAC: [6-amino-8-(furan-2-yl)-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7-tetraen-5-yl]-(4-methylphenyl)methanone.
Chemical Property Profile of ChemDiv1_017223
Property Insights of ChemDiv1_017223
The XLogP value of 5.16662 indicates that ChemDiv1_017223 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.12 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_017223. Following Lipinski's Rule of Five, ChemDiv1_017223 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_017223?
The CAS number of ChemDiv1_017223 is 434291-17-5.
What is the molecular formula of ChemDiv1_017223?
The molecular formula of ChemDiv1_017223 is C22H18N2O2S.
What is the molecular weight of ChemDiv1_017223?
The molecular weight of ChemDiv1_017223 is 374.11 g/mol.
Where can I buy ChemDiv1_017223?
You can request a quote for ChemDiv1_017223 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_017223?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_017223 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.