UPCMLD0ENAT0504-6172:001
TL;DR: UPCMLD0ENAT0504-6172:001 (CAS 315682-74-7) is a chemical compound with molecular formula C23H24N2O7S and molecular weight 472.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: UPCMLD0ENAT0504-6172:001, AF-399/15128455, dimethyl 5-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-3-methylthiophene-2,4-dicarboxylate, dimethyl 5-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoyl]amino}-3-methyl-2,4-thiophenedicarboxylate, methyl 2-[6-(1,3-dioxobenzo[c]azolin-2-yl)hexanoylamino]-5-(methoxycarbonyl)-4 -methylthiophene-3-carboxylate
| Molecular Formula | C23H24N2O7S |
|---|---|
| Molecular Weight | 472.13 g/mol |
| LogP | 3.42482 |
| Topological Polar Surface Area | 119.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 472.13043 |
| Heavy Atoms | 33 |
| Complexity | 1087.0083 |
Chemical Identifiers
| CAS Number | 315682-74-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC |
Product Overview
UPCMLD0ENAT0504-6172:001 (CAS 315682-74-7), with molecular formula C23H24N2O7S and molecular weight 472.13 g/mol. IUPAC: dimethyl 5-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of UPCMLD0ENAT0504-6172:001
Property Insights of UPCMLD0ENAT0504-6172:001
The XLogP value of 3.42482 indicates that UPCMLD0ENAT0504-6172:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.08 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0504-6172:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0504-6172:001 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 UPCMLD0ENAT0504-6172:001?
The CAS number of UPCMLD0ENAT0504-6172:001 is 315682-74-7.
What is the molecular formula of UPCMLD0ENAT0504-6172:001?
The molecular formula of UPCMLD0ENAT0504-6172:001 is C23H24N2O7S.
What is the molecular weight of UPCMLD0ENAT0504-6172:001?
The molecular weight of UPCMLD0ENAT0504-6172:001 is 472.13 g/mol.
Where can I buy UPCMLD0ENAT0504-6172:001?
You can request a quote for UPCMLD0ENAT0504-6172:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0504-6172:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0504-6172:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.