Methyl 3-(aziridine-1-carbonylamino)propanoate
TL;DR: Methyl 3-(aziridine-1-carbonylamino)propanoate (CAS 93285-99-5) is a chemical compound with molecular formula C7H12N2O3 and molecular weight 172.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(aziridine-1-carbonylamino)propanoate
Also Known As: methyl 3-(aziridine-1-carbonylamino)propanoate, b-Alanine,N-(1-aziridinylcarbonyl)-,methyl ester, N-(3-Methoxy-3-oxopropyl)aziridine-1-carboximidic acid
| Molecular Formula | C7H12N2O3 |
|---|---|
| Molecular Weight | 172.08 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 58.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 172.0848 |
| Heavy Atoms | 12 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 93285-99-5 |
|---|---|
| SMILES | COC(=O)CCNC(=O)N1CC1 |
| InChIKey | MHFVPUGQSMRTBO-UHFFFAOYSA-N |
Product Overview
Methyl 3-(aziridine-1-carbonylamino)propanoate (CAS 93285-99-5), with molecular formula C7H12N2O3 and molecular weight 172.08 g/mol. IUPAC: methyl 3-(aziridine-1-carbonylamino)propanoate.
Chemical Property Profile of Methyl 3-(aziridine-1-carbonylamino)propanoate
Property Insights of Methyl 3-(aziridine-1-carbonylamino)propanoate
The XLogP value of -0.9 indicates that Methyl 3-(aziridine-1-carbonylamino)propanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.4 Ų, Methyl 3-(aziridine-1-carbonylamino)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(aziridine-1-carbonylamino)propanoate has 1 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 Methyl 3-(aziridine-1-carbonylamino)propanoate?
The CAS number of Methyl 3-(aziridine-1-carbonylamino)propanoate is 93285-99-5.
What is the molecular formula of Methyl 3-(aziridine-1-carbonylamino)propanoate?
The molecular formula of Methyl 3-(aziridine-1-carbonylamino)propanoate is C7H12N2O3.
What is the molecular weight of Methyl 3-(aziridine-1-carbonylamino)propanoate?
The molecular weight of Methyl 3-(aziridine-1-carbonylamino)propanoate is 172.08 g/mol.
Where can I buy Methyl 3-(aziridine-1-carbonylamino)propanoate?
You can request a quote for Methyl 3-(aziridine-1-carbonylamino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(aziridine-1-carbonylamino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(aziridine-1-carbonylamino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.