![2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e structure](/static/products/5043/50439-35-5.webp)
2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e
TL;DR: 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e (CAS 50439-35-5) is a chemical compound with molecular formula C17H24N4O6 and molecular weight 380.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[1-[[1-(4-nitroanilino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]carbamate
Also Known As: BOC-ALA-ALA-PNA, 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e, tert-butyl N-[1-[[1-(4-nitroanilino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]carbamate, tert-butyl N-[(2S)-1-[[(2S)-1-(4-nitroanilino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]carbamate
| Molecular Formula | C17H24N4O6 |
|---|---|
| Molecular Weight | 380.17 g/mol |
| LogP | 1.9512 |
| Topological Polar Surface Area | 139.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.1696 |
| Heavy Atoms | 27 |
| Complexity | 711.12897 |
Chemical Identifiers
| CAS Number | 50439-35-5 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(C)NC(=O)OC(C)(C)C |
Product Overview
2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e (CAS 50439-35-5), with molecular formula C17H24N4O6 and molecular weight 380.17 g/mol. IUPAC: tert-butyl N-[1-[[1-(4-nitroanilino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]carbamate.
Chemical Property Profile of 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e
Property Insights of 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e
The XLogP value of 1.9512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e. The TPSA of 139.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e. Following Lipinski's Rule of Five, 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e 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 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e?
The CAS number of 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e is 50439-35-5.
What is the molecular formula of 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e?
The molecular formula of 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e is C17H24N4O6.
What is the molecular weight of 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e?
The molecular weight of 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e is 380.17 g/mol.
Where can I buy 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e?
You can request a quote for 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e?
Yes, KEHONG BIO provides custom synthesis services for 2-[(tert-butoxy)carbonylamino]-N-{[N-(4-nitrophenyl)carbamoyl]ethyl}propanamid e and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.