![n-n-[1- propan-2-yl]propanamide,oxalicacid structure](/static/products/7757/77576-48-8.webp)
n-n-[1- propan-2-yl]propanamide,oxalicacid
TL;DR: n-n-[1- propan-2-yl]propanamide,oxalicacid (CAS 77576-48-8) is a chemical compound with molecular formula C31H40N4O10S and molecular weight 660.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethoxy-1,3-benzothiazol-6-yl)-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide;oxalic acid
Also Known As: n-n-[1- propan-2-yl]propanamide,oxalicacid, 2-Ethoxy-6-(N-(1-methyl-2-(4-phenethylpiperazino)ethyl)propionamide)benzothiazole dioxalate, Propanamide, N-(2-ethoxy-6-benzothiazolyl)-N-(1-methyl-2-(4-(2-phenylethyl)-1-piperazinyl)ethyl)-, ethanedioate (1:2), N-(2-ethoxy-1,3-benzothiazol-6-yl)-N-[1-(4-phenethylpiperazin-1-yl)propan-2-yl]propanamide; oxalic acid, N-(2-ethoxy-1,3-benzothiazol-6-yl)-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide,oxalic acid
| Molecular Formula | C31H40N4O10S |
|---|---|
| Molecular Weight | 660.25 g/mol |
| LogP | 2.998 |
| Topological Polar Surface Area | 198.11 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 660.2465 |
| Heavy Atoms | 46 |
| Complexity | 1410.0337 |
Chemical Identifiers
| CAS Number | 77576-48-8 |
|---|---|
| SMILES | CCC(=O)N(C1=CC2=C(C=C1)N=C(S2)OCC)C(C)CN3CCN(CC3)CCC4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O |
Product Overview
n-n-[1- propan-2-yl]propanamide,oxalicacid (CAS 77576-48-8), with molecular formula C31H40N4O10S and molecular weight 660.25 g/mol. IUPAC: N-(2-ethoxy-1,3-benzothiazol-6-yl)-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide;oxalic acid.
Chemical Property Profile of n-n-[1- propan-2-yl]propanamide,oxalicacid
Property Insights of n-n-[1- propan-2-yl]propanamide,oxalicacid
The XLogP value of 2.998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-n-[1- propan-2-yl]propanamide,oxalicacid. The TPSA of 198.11 Ų indicates high polarity, suggesting n-n-[1- propan-2-yl]propanamide,oxalicacid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, n-n-[1- propan-2-yl]propanamide,oxalicacid has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of n-n-[1- propan-2-yl]propanamide,oxalicacid?
The CAS number of n-n-[1- propan-2-yl]propanamide,oxalicacid is 77576-48-8.
What is the molecular formula of n-n-[1- propan-2-yl]propanamide,oxalicacid?
The molecular formula of n-n-[1- propan-2-yl]propanamide,oxalicacid is C31H40N4O10S.
What is the molecular weight of n-n-[1- propan-2-yl]propanamide,oxalicacid?
The molecular weight of n-n-[1- propan-2-yl]propanamide,oxalicacid is 660.25 g/mol.
Where can I buy n-n-[1- propan-2-yl]propanamide,oxalicacid?
You can request a quote for n-n-[1- propan-2-yl]propanamide,oxalicacid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-n-[1- propan-2-yl]propanamide,oxalicacid?
Yes, KEHONG BIO provides custom synthesis services for n-n-[1- propan-2-yl]propanamide,oxalicacid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.