UPCMLD0ENAT0513-7715:001
TL;DR: UPCMLD0ENAT0513-7715:001 (CAS 315685-25-7) is a chemical compound with molecular formula C20H30N2O3S and molecular weight 378.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methyl-2-[[2-(4-methylpiperidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: UPCMLD0ENAT0513-7715:001, AF-399/15336019, ethyl 6-methyl-2-{[(4-methyl-1-piperidinyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 6-methyl-2-[[2-(4-methylpiperidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 6-methyl-2-(2-(4-methylpiperidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C20H30N2O3S |
|---|---|
| Molecular Weight | 378.20 g/mol |
| LogP | 3.72 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.19772 |
| Heavy Atoms | 26 |
| Complexity | 662.2587 |
Chemical Identifiers
| CAS Number | 315685-25-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)CN3CCC(CC3)C |
Product Overview
UPCMLD0ENAT0513-7715:001 (CAS 315685-25-7), with molecular formula C20H30N2O3S and molecular weight 378.20 g/mol. IUPAC: ethyl 6-methyl-2-[[2-(4-methylpiperidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of UPCMLD0ENAT0513-7715:001
Property Insights of UPCMLD0ENAT0513-7715:001
The XLogP value of 3.72 indicates that UPCMLD0ENAT0513-7715:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, UPCMLD0ENAT0513-7715:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0513-7715:001 has 1 hydrogen bond donor(s) and 5 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 UPCMLD0ENAT0513-7715:001?
The CAS number of UPCMLD0ENAT0513-7715:001 is 315685-25-7.
What is the molecular formula of UPCMLD0ENAT0513-7715:001?
The molecular formula of UPCMLD0ENAT0513-7715:001 is C20H30N2O3S.
What is the molecular weight of UPCMLD0ENAT0513-7715:001?
The molecular weight of UPCMLD0ENAT0513-7715:001 is 378.20 g/mol.
Where can I buy UPCMLD0ENAT0513-7715:001?
You can request a quote for UPCMLD0ENAT0513-7715:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0513-7715:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0513-7715:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.