Boc-L-Asn-O-CH2-Ph-CH2-COOH
TL;DR: Boc-L-Asn-O-CH2-Ph-CH2-COOH (CAS 73401-72-6) is a chemical compound with molecular formula C18H24N2O7 and molecular weight 380.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[(2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoyl]oxymethyl]phenyl]acetic acid
Also Known As: Boc-l-asn-o-ch2-f-ch2-cooh, Boc-L-Asn-O-CH2-Ph-CH2-COOH, (S)-2-(4-(((4-Amino-2-((tert-butoxycarbonyl)amino)-4-oxobutanoyl)oxy)methyl)phenyl)acetic acid, 2-{4-[({4-amino-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoyl}oxy)methyl]phenyl}acetic acid, 2-[4-[[(2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoyl]oxymethyl]phenyl]acetic acid
| Molecular Formula | C18H24N2O7 |
|---|---|
| Molecular Weight | 380.16 g/mol |
| LogP | 1.1256 |
| Topological Polar Surface Area | 145.02 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.15836 |
| Heavy Atoms | 27 |
| Complexity | 692.65686 |
Chemical Identifiers
| CAS Number | 73401-72-6 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC(=O)N)C(=O)OCC1=CC=C(C=C1)CC(=O)O |
Product Overview
Boc-L-Asn-O-CH2-Ph-CH2-COOH (CAS 73401-72-6), with molecular formula C18H24N2O7 and molecular weight 380.16 g/mol. IUPAC: 2-[4-[[(2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoyl]oxymethyl]phenyl]acetic acid.
Chemical Property Profile of Boc-L-Asn-O-CH2-Ph-CH2-COOH
Property Insights of Boc-L-Asn-O-CH2-Ph-CH2-COOH
The XLogP value of 1.1256 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-L-Asn-O-CH2-Ph-CH2-COOH. The TPSA of 145.02 Ų indicates high polarity, suggesting Boc-L-Asn-O-CH2-Ph-CH2-COOH may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Boc-L-Asn-O-CH2-Ph-CH2-COOH has 3 hydrogen bond donor(s) and 6 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 Boc-L-Asn-O-CH2-Ph-CH2-COOH?
The CAS number of Boc-L-Asn-O-CH2-Ph-CH2-COOH is 73401-72-6.
What is the molecular formula of Boc-L-Asn-O-CH2-Ph-CH2-COOH?
The molecular formula of Boc-L-Asn-O-CH2-Ph-CH2-COOH is C18H24N2O7.
What is the molecular weight of Boc-L-Asn-O-CH2-Ph-CH2-COOH?
The molecular weight of Boc-L-Asn-O-CH2-Ph-CH2-COOH is 380.16 g/mol.
Where can I buy Boc-L-Asn-O-CH2-Ph-CH2-COOH?
You can request a quote for Boc-L-Asn-O-CH2-Ph-CH2-COOH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-L-Asn-O-CH2-Ph-CH2-COOH?
Yes, KEHONG BIO provides custom synthesis services for Boc-L-Asn-O-CH2-Ph-CH2-COOH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.