ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate
TL;DR: ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate (CAS 6637-63-4) is a chemical compound with molecular formula C12H17N3O2 and molecular weight 235.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[[4-(dimethylamino)phenyl]methylideneamino]carbamate
Also Known As: ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate, ethyl N-[[4-(dimethylamino)phenyl]methylideneamino]carbamate, Hydrazinecarboxylicacid, 2-[[4-(dimethylamino)phenyl]methylene]-, ethyl ester, Ethyl 2-{[4-(dimethylamino)phenyl]methylidene}hydrazine-1-carboxylate
| Molecular Formula | C12H17N3O2 |
|---|---|
| Molecular Weight | 235.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 235.13208 |
| Heavy Atoms | 17 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 6637-63-4 |
|---|---|
| SMILES | CCOC(=O)NN=CC1=CC=C(C=C1)N(C)C |
| InChIKey | UFPYMTLVBJSQJK-UHFFFAOYSA-N |
Product Overview
ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate (CAS 6637-63-4), with molecular formula C12H17N3O2 and molecular weight 235.13 g/mol. IUPAC: ethyl N-[[4-(dimethylamino)phenyl]methylideneamino]carbamate.
Chemical Property Profile of ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate
Property Insights of ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate. With a topological polar surface area (TPSA) of 53.9 Ų, ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate has 1 hydrogen bond donor(s) and 4 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 ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate?
The CAS number of ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate is 6637-63-4.
What is the molecular formula of ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate?
The molecular formula of ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate is C12H17N3O2.
What is the molecular weight of ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate?
The molecular weight of ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate is 235.13 g/mol.
Where can I buy ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate?
You can request a quote for ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[(4-dimethylaminophenyl)methylideneamino]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.