Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate
TL;DR: Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate (CAS 92653-95-7) is a chemical compound with molecular formula C15H20N4O4 and molecular weight 320.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[2-oxo-2-[2-(pyrrolidine-2-carbonyl)hydrazinyl]ethyl]carbamate
Also Known As: BENZYL N-[(PYRROLIDINE-2-CARBONYLAMINO)CARBAMOYLMETHYL]CARBAMATE, benzyl N-[2-oxo-2-[2-(pyrrolidine-2-carbonyl)hydrazinyl]ethyl]carbamate, Benzyl {2-oxo-2-[2-(pyrrolidine-2-carbonyl)hydrazin-1-yl]ethyl}carbamate, Benzyl {2-oxo-2-[2-(pyrrolidine-2-carbonyl)hydrazinyl]ethyl}carbamate
| Molecular Formula | C15H20N4O4 |
|---|---|
| Molecular Weight | 320.15 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.14847 |
| Heavy Atoms | 23 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 92653-95-7 |
|---|---|
| SMILES | C1CC(NC1)C(=O)NNC(=O)CNC(=O)OCC2=CC=CC=C2 |
| InChIKey | UKRNHXVKPRYWGU-UHFFFAOYSA-N |
Product Overview
Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate (CAS 92653-95-7), with molecular formula C15H20N4O4 and molecular weight 320.15 g/mol. IUPAC: benzyl N-[2-oxo-2-[2-(pyrrolidine-2-carbonyl)hydrazinyl]ethyl]carbamate.
Chemical Property Profile of Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate
Property Insights of Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate. Following Lipinski's Rule of Five, Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate 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 Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate?
The CAS number of Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate is 92653-95-7.
What is the molecular formula of Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate?
The molecular formula of Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate is C15H20N4O4.
What is the molecular weight of Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate?
The molecular weight of Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate is 320.15 g/mol.
Where can I buy Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate?
You can request a quote for Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl N-[(pyrrolidine-2-carbonylamino)carbamoylmethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.