N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine
TL;DR: N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine (CAS 1047680-91-0) is a chemical compound with molecular formula C12H17N3O4 and molecular weight 267.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(3-hydroxypropylamino)-4-oxo-4-(pyridin-3-ylamino)butanoic acid
Also Known As: N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine, (2S)-2-(3-hydroxypropylamino)-3-(pyridin-3-ylcarbamoyl)propanoic Acid
| Molecular Formula | C12H17N3O4 |
|---|---|
| Molecular Weight | 267.12 g/mol |
| LogP | -0.1646 |
| Topological Polar Surface Area | 111.55 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 267.12192 |
| Heavy Atoms | 19 |
| Complexity | 410.69534 |
Chemical Identifiers
| CAS Number | 1047680-91-0 |
|---|---|
| SMILES | C1=CC(=CN=C1)NC(=O)C[C@@H](C(=O)O)NCCCO |
Product Overview
N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine (CAS 1047680-91-0), with molecular formula C12H17N3O4 and molecular weight 267.12 g/mol. IUPAC: (2S)-2-(3-hydroxypropylamino)-4-oxo-4-(pyridin-3-ylamino)butanoic acid.
Chemical Property Profile of N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine
Property Insights of N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine
The XLogP value of -0.1646 indicates that N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.55 Ų falls within the moderate polarity range, balancing permeability and solubility for N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine. Following Lipinski's Rule of Five, N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine has 4 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 N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine?
The CAS number of N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine is 1047680-91-0.
What is the molecular formula of N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine?
The molecular formula of N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine is C12H17N3O4.
What is the molecular weight of N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine?
The molecular weight of N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine is 267.12 g/mol.
Where can I buy N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine?
You can request a quote for N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine?
Yes, KEHONG BIO provides custom synthesis services for N2-(3-Hydroxypropyl)-N4-(pyridin-3-yl)-L-asparagine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.