L-Alanine,N-propyl
TL;DR: L-Alanine,N-propyl (CAS 13013-78-0) is a chemical compound with molecular formula C26H16I6N4O8 and molecular weight 1273.52 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
Also Known As: L-Alanine,N-propyl, Isophthalamic acid, 5,5'-(1,4-phenylenebis(carbonylimino))bis(N-methyl-2,4,6-triiodo-, 5,5'-(1,4-Phenylenebis(carbonylimino))bis(N-methyl-2,4,6-triiodoisophthalamic acid), 3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid, 5,5 -(Terephthaloyldiimino)bis[2,4,6-triiodo-N-methylisophthalamic acid]
| Molecular Formula | C26H16I6N4O8 |
|---|---|
| Molecular Weight | 1273.52 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 1273.5236 |
| Heavy Atoms | 44 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 13013-78-0 |
|---|---|
| SMILES | CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)C2=CC=C(C=C2)C(=O)NC3=C(C(=C(C(=C3I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I |
| InChIKey | DMBFAHBQOUZNMT-UHFFFAOYSA-N |
Product Overview
L-Alanine,N-propyl (CAS 13013-78-0), with molecular formula C26H16I6N4O8 and molecular weight 1273.52 g/mol. IUPAC: 3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid.
Chemical Property Profile of L-Alanine,N-propyl
Property Insights of L-Alanine,N-propyl
The XLogP value of 5.1 indicates that L-Alanine,N-propyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 191.0 Ų indicates high polarity, suggesting L-Alanine,N-propyl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L-Alanine,N-propyl has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of L-Alanine,N-propyl?
The CAS number of L-Alanine,N-propyl is 13013-78-0.
What is the molecular formula of L-Alanine,N-propyl?
The molecular formula of L-Alanine,N-propyl is C26H16I6N4O8.
What is the molecular weight of L-Alanine,N-propyl?
The molecular weight of L-Alanine,N-propyl is 1273.52 g/mol.
Where can I buy L-Alanine,N-propyl?
You can request a quote for L-Alanine,N-propyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-Alanine,N-propyl?
Yes, KEHONG BIO provides custom synthesis services for L-Alanine,N-propyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.