A0180/0008109
TL;DR: A0180/0008109 (CAS 296796-97-9) is a chemical compound with molecular formula C19H17ClN2OS and molecular weight 356.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-amino-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(4-chlorophenyl)methanone
Also Known As: A0180/0008109, (1-Amino-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)(4-chlorophenyl)methanone, 1-Amino-2-(4-chlorobenzoyl)-6,7,8,9-tetrahydro-5-methylthieno[2,3-c]isoquinoline, 2-(4-CHLOROBENZOYL)-5-METHYL-6H,7H,8H,9H-THIENO[2,3-C]ISOQUINOLIN-1-AMINE, (1-Amino-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)(4-chlorophenyl)methanone #
| Molecular Formula | C19H17ClN2OS |
|---|---|
| Molecular Weight | 356.07 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.075 |
| Heavy Atoms | 24 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 296796-97-9 |
|---|---|
| SMILES | CC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)C4=CC=C(C=C4)Cl)N |
| InChIKey | OPHKXVVEJWPYOF-UHFFFAOYSA-N |
Product Overview
A0180/0008109 (CAS 296796-97-9), with molecular formula C19H17ClN2OS and molecular weight 356.07 g/mol. IUPAC: (1-amino-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(4-chlorophenyl)methanone.
Chemical Property Profile of A0180/0008109
Property Insights of A0180/0008109
The XLogP value of 6.2 indicates that A0180/0008109 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for A0180/0008109. Following Lipinski's Rule of Five, A0180/0008109 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A0180/0008109?
The CAS number of A0180/0008109 is 296796-97-9.
What is the molecular formula of A0180/0008109?
The molecular formula of A0180/0008109 is C19H17ClN2OS.
What is the molecular weight of A0180/0008109?
The molecular weight of A0180/0008109 is 356.07 g/mol.
Where can I buy A0180/0008109?
You can request a quote for A0180/0008109 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0180/0008109?
Yes, KEHONG BIO provides custom synthesis services for A0180/0008109 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.