DL-N-Benzoyl-2-isopropylserine
TL;DR: DL-N-Benzoyl-2-isopropylserine (CAS 52421-46-2) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzamido-2-(hydroxymethyl)-3-methylbutanoic acid
Also Known As: DL-N-BENZOYL-2-ISOPROPYLSERINE, Valine,N-benzoyl-2-(hydroxymethyl)-, Benzenemethanamine,2-chloro-a-methyl-,(S)-, 2-benzamido-2-(hydroxymethyl)-3-methylbutanoic acid, 2-benzamido-2-(hydroxymethyl)-3-methyl-butanoic Acid
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 0.8881 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 429.8772 |
Chemical Identifiers
| CAS Number | 52421-46-2 |
|---|---|
| SMILES | CC(C)C(CO)(C(=O)O)NC(=O)C1=CC=CC=C1 |
Product Overview
DL-N-Benzoyl-2-isopropylserine (CAS 52421-46-2), with molecular formula C13H17NO4 and molecular weight 251.12 g/mol. IUPAC: 2-benzamido-2-(hydroxymethyl)-3-methylbutanoic acid.
Chemical Property Profile of DL-N-Benzoyl-2-isopropylserine
Property Insights of DL-N-Benzoyl-2-isopropylserine
The XLogP value of 0.8881 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DL-N-Benzoyl-2-isopropylserine. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for DL-N-Benzoyl-2-isopropylserine. Following Lipinski's Rule of Five, DL-N-Benzoyl-2-isopropylserine has 3 hydrogen bond donor(s) and 3 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 DL-N-Benzoyl-2-isopropylserine?
The CAS number of DL-N-Benzoyl-2-isopropylserine is 52421-46-2.
What is the molecular formula of DL-N-Benzoyl-2-isopropylserine?
The molecular formula of DL-N-Benzoyl-2-isopropylserine is C13H17NO4.
What is the molecular weight of DL-N-Benzoyl-2-isopropylserine?
The molecular weight of DL-N-Benzoyl-2-isopropylserine is 251.12 g/mol.
Where can I buy DL-N-Benzoyl-2-isopropylserine?
You can request a quote for DL-N-Benzoyl-2-isopropylserine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DL-N-Benzoyl-2-isopropylserine?
Yes, KEHONG BIO provides custom synthesis services for DL-N-Benzoyl-2-isopropylserine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.