Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate
TL;DR: Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate (CAS 901274-08-6) is a chemical compound with molecular formula C16H23N3O3 and molecular weight 305.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(1-ethylpiperidin-4-yl)carbamoylamino]benzoate
Also Known As: methyl 2-(3-(1-ethylpiperidin-4-yl)ureido)benzoate, Methyl 2-[(1-ethyl-4-piperidyl)carbamoylamino]benzoate, methyl 2-[(1-ethylpiperidin-4-yl)carbamoylamino]benzoate, methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate, methyl 2-{[(1-ethyl-4-piperidyl)amino]carbonylamino}benzoate
| Molecular Formula | C16H23N3O3 |
|---|---|
| Molecular Weight | 305.17 g/mol |
| LogP | 2.079 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.17395 |
| Heavy Atoms | 22 |
| Complexity | 525.12225 |
Chemical Identifiers
| CAS Number | 901274-08-6 |
|---|---|
| SMILES | CCN1CCC(CC1)NC(=O)NC2=CC=CC=C2C(=O)OC |
Product Overview
Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate (CAS 901274-08-6), with molecular formula C16H23N3O3 and molecular weight 305.17 g/mol. IUPAC: methyl 2-[(1-ethylpiperidin-4-yl)carbamoylamino]benzoate.
Chemical Property Profile of Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate
Property Insights of Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate
The XLogP value of 2.079 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate has 2 hydrogen bond donor(s) and 4 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 Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate?
The CAS number of Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate is 901274-08-6.
What is the molecular formula of Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate?
The molecular formula of Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate is C16H23N3O3.
What is the molecular weight of Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate?
The molecular weight of Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate is 305.17 g/mol.
Where can I buy Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate?
You can request a quote for Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[(1-ethylpiperidin-4-yl)carbamoyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.