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Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate
TL;DR: Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate (CAS 51220-84-9) is a chemical compound with molecular formula C14H21NO4S and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate
Also Known As: Methyl tosylleucinate, FERROUSCHLORIDE, Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate, N-Tosyl-L-leucine methyl ester, 4616AE
| Molecular Formula | C14H21NO4S |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 1.86102 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.11914 |
| Heavy Atoms | 20 |
| Complexity | 549.04156 |
Chemical Identifiers
| CAS Number | 51220-84-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC |
Product Overview
Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate (CAS 51220-84-9), with molecular formula C14H21NO4S and molecular weight 299.12 g/mol. IUPAC: methyl 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate.
Chemical Property Profile of Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate
Property Insights of Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate
The XLogP value of 1.86102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate. Following Lipinski's Rule of Five, Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate has 1 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 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate?
The CAS number of Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate is 51220-84-9.
What is the molecular formula of Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate?
The molecular formula of Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate is C14H21NO4S.
What is the molecular weight of Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate?
The molecular weight of Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate is 299.12 g/mol.
Where can I buy Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate?
You can request a quote for Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-methyl-2-{[(4-methylphenyl)sulfonyl]-amino}pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.