ChemDiv1_000229
TL;DR: ChemDiv1_000229 (CAS 174705-67-0) is a chemical compound with molecular formula C20H28N4O3S and molecular weight 404.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-amino-7,8,8-trimethyl-5-morpholin-4-yl-6,9-dihydrothieno[2,3-c][2,7]naphthyridine-2-carboxylate
Also Known As: ChemDiv1_000229, BAS 04207114, ethyl 1-amino-7,8,8-trimethyl-5-morpholin-4-yl-6,9-dihydrothieno[2,3-c][2,7]naphthyridine-2-carboxylate, ETHYL 1-AMINO-7,8,8-TRIMETHYL-5-MORPHOLINO-6,7,8,9-TETRAHYDROTHIENO[2,3-C][2,7]NAPHTHYRIDINE-2-CARBOXYLATE, ethyl 1-amino-7,8,8-trimethyl-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c][2,7]naphthyridine-2-carboxylate
| Molecular Formula | C20H28N4O3S |
|---|---|
| Molecular Weight | 404.19 g/mol |
| LogP | 2.6583 |
| Topological Polar Surface Area | 80.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.1882 |
| Heavy Atoms | 28 |
| Complexity | 918.04694 |
Chemical Identifiers
| CAS Number | 174705-67-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=C(C3=C2CC(N(C3)C)(C)C)N4CCOCC4)N |
Product Overview
ChemDiv1_000229 (CAS 174705-67-0), with molecular formula C20H28N4O3S and molecular weight 404.19 g/mol. IUPAC: ethyl 1-amino-7,8,8-trimethyl-5-morpholin-4-yl-6,9-dihydrothieno[2,3-c][2,7]naphthyridine-2-carboxylate.
Chemical Property Profile of ChemDiv1_000229
Property Insights of ChemDiv1_000229
The XLogP value of 2.6583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_000229. The TPSA of 80.92 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_000229. Following Lipinski's Rule of Five, ChemDiv1_000229 has 1 hydrogen bond donor(s) and 8 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 ChemDiv1_000229?
The CAS number of ChemDiv1_000229 is 174705-67-0.
What is the molecular formula of ChemDiv1_000229?
The molecular formula of ChemDiv1_000229 is C20H28N4O3S.
What is the molecular weight of ChemDiv1_000229?
The molecular weight of ChemDiv1_000229 is 404.19 g/mol.
Where can I buy ChemDiv1_000229?
You can request a quote for ChemDiv1_000229 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_000229?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_000229 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.