UPCMLD0ENAT5967566:001
TL;DR: UPCMLD0ENAT5967566:001 (CAS 381684-20-4) is a chemical compound with molecular formula C19H21N3O5S and molecular weight 403.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyethyl)-2-[(4-nitrobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: UPCMLD0ENAT5967566:001, AB00118147-01, N-(2-methoxyethyl)-2-[(4-nitrobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-(2-methoxyethyl)-2-(4-nitrobenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, N-(2-methoxyethyl)-2-{[(4-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C19H21N3O5S |
|---|---|
| Molecular Weight | 403.12 g/mol |
| LogP | 3.1636 |
| Topological Polar Surface Area | 110.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.12018 |
| Heavy Atoms | 28 |
| Complexity | 891.71924 |
Chemical Identifiers
| CAS Number | 381684-20-4 |
|---|---|
| SMILES | COCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
UPCMLD0ENAT5967566:001 (CAS 381684-20-4), with molecular formula C19H21N3O5S and molecular weight 403.12 g/mol. IUPAC: N-(2-methoxyethyl)-2-[(4-nitrobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of UPCMLD0ENAT5967566:001
Property Insights of UPCMLD0ENAT5967566:001
The XLogP value of 3.1636 indicates that UPCMLD0ENAT5967566:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.57 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5967566:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5967566:001 has 2 hydrogen bond donor(s) and 6 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 UPCMLD0ENAT5967566:001?
The CAS number of UPCMLD0ENAT5967566:001 is 381684-20-4.
What is the molecular formula of UPCMLD0ENAT5967566:001?
The molecular formula of UPCMLD0ENAT5967566:001 is C19H21N3O5S.
What is the molecular weight of UPCMLD0ENAT5967566:001?
The molecular weight of UPCMLD0ENAT5967566:001 is 403.12 g/mol.
Where can I buy UPCMLD0ENAT5967566:001?
You can request a quote for UPCMLD0ENAT5967566:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5967566:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5967566:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.