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Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate
TL;DR: Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate (CAS 349096-40-8) is a chemical compound with molecular formula C18H17NO5 and molecular weight 327.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(3-methylbenzoyl)amino]benzene-1,4-dicarboxylate
Also Known As: dimethyl 2-[(3-methylbenzoyl)amino]terephthalate, AO-548/11634365, dimethyl 2-[(3-methylbenzoyl)amino]benzene-1,4-dicarboxylate
| Molecular Formula | C18H17NO5 |
|---|---|
| Molecular Weight | 327.11 g/mol |
| LogP | 2.82052 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.1107 |
| Heavy Atoms | 24 |
| Complexity | 797.74615 |
Chemical Identifiers
| CAS Number | 349096-40-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC |
Product Overview
Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate (CAS 349096-40-8), with molecular formula C18H17NO5 and molecular weight 327.11 g/mol. IUPAC: dimethyl 2-[(3-methylbenzoyl)amino]benzene-1,4-dicarboxylate.
Chemical Property Profile of Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate
Property Insights of Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate
The XLogP value of 2.82052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate. Following Lipinski's Rule of Five, Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate 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 Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate?
The CAS number of Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate is 349096-40-8.
What is the molecular formula of Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate?
The molecular formula of Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate is C18H17NO5.
What is the molecular weight of Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate?
The molecular weight of Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate is 327.11 g/mol.
Where can I buy Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate?
You can request a quote for Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-[(3-methylbenzoyl)amino]terephthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.