UPCMLD0ENAT5726338:001
TL;DR: UPCMLD0ENAT5726338:001 (CAS 899954-17-7) is a chemical compound with molecular formula C18H18N2O5S and molecular weight 374.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2-methoxyphenyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Also Known As: UPCMLD0ENAT5726338:001, VU0495720-1, N-[2-(2-methoxyphenyl)ethyl]-2-(1,1,3-trioxo-2,3-dihydro-1lambda6,2-benzothiazol-2-yl)acetamide, N-[2-(2-methoxyphenyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide, 2-(1,1-dioxido-3-oxobenzo[d]isothiazol-2(3H)-yl)-N-(2-methoxyphenethyl)acetamide
| Molecular Formula | C18H18N2O5S |
|---|---|
| Molecular Weight | 374.09 g/mol |
| LogP | 1.1986 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.09363 |
| Heavy Atoms | 26 |
| Complexity | 955.5587 |
Chemical Identifiers
| CAS Number | 899954-17-7 |
|---|---|
| SMILES | COC1=CC=CC=C1CCNC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O |
Product Overview
UPCMLD0ENAT5726338:001 (CAS 899954-17-7), with molecular formula C18H18N2O5S and molecular weight 374.09 g/mol. IUPAC: N-[2-(2-methoxyphenyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide.
Chemical Property Profile of UPCMLD0ENAT5726338:001
Property Insights of UPCMLD0ENAT5726338:001
The XLogP value of 1.1986 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5726338:001. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5726338:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5726338:001 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 UPCMLD0ENAT5726338:001?
The CAS number of UPCMLD0ENAT5726338:001 is 899954-17-7.
What is the molecular formula of UPCMLD0ENAT5726338:001?
The molecular formula of UPCMLD0ENAT5726338:001 is C18H18N2O5S.
What is the molecular weight of UPCMLD0ENAT5726338:001?
The molecular weight of UPCMLD0ENAT5726338:001 is 374.09 g/mol.
Where can I buy UPCMLD0ENAT5726338:001?
You can request a quote for UPCMLD0ENAT5726338:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5726338:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5726338:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.