UPCMLD0ENAT0517-1079:001
TL;DR: UPCMLD0ENAT0517-1079:001 (CAS 568559-15-9) is a chemical compound with molecular formula C18H17NO3S3 and molecular weight 391.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-ethyl-2-(thiophene-2-carbonylamino)-4-thiophen-2-ylthiophene-3-carboxylate
Also Known As: UPCMLD0ENAT0517-1079:001, BRD-K08667472-001-04-4, ethyl 2'-ethyl-5'-(thiophene-2-carboxamido)-[2,3'-bithiophene]-4'-carboxylate, ethyl 5-ethyl-2-(thiophene-2-carbonylamino)-4-thiophen-2-ylthiophene-3-carboxylate, 5-ethyl-2-(2-thenoylamino)-4-(2-thienyl)thiophene-3-carboxylic acid ethyl ester
| Molecular Formula | C18H17NO3S3 |
|---|---|
| Molecular Weight | 391.04 g/mol |
| LogP | 5.5295 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.03705 |
| Heavy Atoms | 25 |
| Complexity | 863.9148 |
Chemical Identifiers
| CAS Number | 568559-15-9 |
|---|---|
| SMILES | CCC1=C(C(=C(S1)NC(=O)C2=CC=CS2)C(=O)OCC)C3=CC=CS3 |
Product Overview
UPCMLD0ENAT0517-1079:001 (CAS 568559-15-9), with molecular formula C18H17NO3S3 and molecular weight 391.04 g/mol. IUPAC: ethyl 5-ethyl-2-(thiophene-2-carbonylamino)-4-thiophen-2-ylthiophene-3-carboxylate.
Chemical Property Profile of UPCMLD0ENAT0517-1079:001
Property Insights of UPCMLD0ENAT0517-1079:001
The XLogP value of 5.5295 indicates that UPCMLD0ENAT0517-1079:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, UPCMLD0ENAT0517-1079:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0517-1079:001 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0517-1079:001?
The CAS number of UPCMLD0ENAT0517-1079:001 is 568559-15-9.
What is the molecular formula of UPCMLD0ENAT0517-1079:001?
The molecular formula of UPCMLD0ENAT0517-1079:001 is C18H17NO3S3.
What is the molecular weight of UPCMLD0ENAT0517-1079:001?
The molecular weight of UPCMLD0ENAT0517-1079:001 is 391.04 g/mol.
Where can I buy UPCMLD0ENAT0517-1079:001?
You can request a quote for UPCMLD0ENAT0517-1079:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0517-1079:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0517-1079:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.