![N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine structure](/static/products/957/957046-65-0.png)
N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine
TL;DR: N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine (CAS 957046-65-0) is a chemical compound with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-4-methylsulfanylbutanoic acid
Also Known As: N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine, (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-4-methylsulfanylbutanoic acid, (S)-2-(3-(benzo[d][1,3]dioxol-5-ylmethyl)ureido)-4-(methylthio)butanoic acid, 2-(benzo[1,3]dioxol-5-ylmethylcarbamoylamino)-4-methylsulfanyl-butanoic Acid
| Molecular Formula | C14H18N2O5S |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 1.4208 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 326.09363 |
| Heavy Atoms | 22 |
| Complexity | 552.0348 |
Chemical Identifiers
| CAS Number | 957046-65-0 |
|---|---|
| SMILES | CSCC[C@@H](C(=O)O)NC(=O)NCC1=CC2=C(C=C1)OCO2 |
Product Overview
N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine (CAS 957046-65-0), with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol. IUPAC: (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-4-methylsulfanylbutanoic acid.
Chemical Property Profile of N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine
Property Insights of N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine
The XLogP value of 1.4208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine. Following Lipinski's Rule of Five, N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine has 3 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 N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine?
The CAS number of N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine is 957046-65-0.
What is the molecular formula of N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine?
The molecular formula of N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine is C14H18N2O5S.
What is the molecular weight of N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine?
The molecular weight of N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine is 326.09 g/mol.
Where can I buy N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine?
You can request a quote for N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine?
Yes, KEHONG BIO provides custom synthesis services for N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-methionine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.