![[[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate structure](/static/products/4780/478048-92-9.webp)
[[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate
TL;DR: [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate (CAS 478048-92-9) is a chemical compound with molecular formula C16H23N3O5 and molecular weight 337.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate
Also Known As: [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate, 1-[3,3-dimethyl-2-({[(propylamino)carbonyl]oxy}imino)butoxy]-2-nitrobenzene
| Molecular Formula | C16H23N3O5 |
|---|---|
| Molecular Weight | 337.16 g/mol |
| LogP | 3.5119 |
| Topological Polar Surface Area | 103.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 337.16376 |
| Heavy Atoms | 24 |
| Complexity | 607.9756 |
Chemical Identifiers
| CAS Number | 478048-92-9 |
|---|---|
| SMILES | CCCNC(=O)ON=C(COC1=CC=CC=C1[N+](=O)[O-])C(C)(C)C |
Product Overview
[[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate (CAS 478048-92-9), with molecular formula C16H23N3O5 and molecular weight 337.16 g/mol. IUPAC: [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate.
Chemical Property Profile of [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate
Property Insights of [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate
The XLogP value of 3.5119 indicates that [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.06 Ų falls within the moderate polarity range, balancing permeability and solubility for [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate. Following Lipinski's Rule of Five, [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate has 1 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 [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate?
The CAS number of [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate is 478048-92-9.
What is the molecular formula of [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate?
The molecular formula of [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate is C16H23N3O5.
What is the molecular weight of [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate?
The molecular weight of [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate is 337.16 g/mol.
Where can I buy [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate?
You can request a quote for [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]amino] N-propylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.