2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid
TL;DR: 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid (CAS 866145-94-0) is a chemical compound with molecular formula C13H17N3O7S and molecular weight 359.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-methyl-4-morpholin-4-ylsulfonyl-2-nitroanilino)acetic acid
Also Known As: 2-[methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid, 2-{methyl[4-(morpholine-4-sulfonyl)-2-nitrophenyl]amino}acetic acid, N-methyl-N-(4-(morpholinosulfonyl)-2-nitrophenyl)glycine, 2-(N-methyl-4-morpholin-4-ylsulfonyl-2-nitroanilino)acetic acid, 2-(N-methyl-4-morpholinosulfonyl-2-nitro-anilino)acetic acid
| Molecular Formula | C13H17N3O7S |
|---|---|
| Molecular Weight | 359.08 g/mol |
| LogP | 0.1365 |
| Topological Polar Surface Area | 130.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.07874 |
| Heavy Atoms | 24 |
| Complexity | 743.93225 |
Chemical Identifiers
| CAS Number | 866145-94-0 |
|---|---|
| SMILES | CN(CC(=O)O)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-] |
Product Overview
2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid (CAS 866145-94-0), with molecular formula C13H17N3O7S and molecular weight 359.08 g/mol. IUPAC: 2-(N-methyl-4-morpholin-4-ylsulfonyl-2-nitroanilino)acetic acid.
Chemical Property Profile of 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid
Property Insights of 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid
The XLogP value of 0.1365 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid. The TPSA of 130.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid. Following Lipinski's Rule of Five, 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid has 1 hydrogen bond donor(s) and 7 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 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid?
The CAS number of 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid is 866145-94-0.
What is the molecular formula of 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid?
The molecular formula of 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid is C13H17N3O7S.
What is the molecular weight of 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid?
The molecular weight of 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid is 359.08 g/mol.
Where can I buy 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid?
You can request a quote for 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[Methyl-4-(morpholinosulfonyl)-2-nitroanilino]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.