![methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate structure](/static/products/5382/53828-09-4.webp)
methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate
TL;DR: methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate (CAS 53828-09-4) is a chemical compound with molecular formula C19H20N4O2 and molecular weight 336.15863 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate
Also Known As: methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate, UPCMLD0ENAT0502-9195:001, F0020-0869, 2,2-dibenzylamino-1-cyanoethenyl methanecarbamate, methyl N-[2,2-bis(benzylamino)-1-cyanoeth-1-en-1-yl]carbamate
Technical Specifications
| Molecular Formula | C19H20N4O2 |
| Molecular Weight | 336.15863 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 86.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 336.15863 Da |
| Heavy Atoms | 25 |
| Complexity | 473.0 |
| SMILES | COC(=O)NC(=C(NCC1=CC=CC=C1)NCC2=CC=CC=C2)C#N |
| InChIKey | OTEATBNBHHZTBW-UHFFFAOYSA-N |
Chemical Property Profile of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate
Property Insights of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate
The XLogP value of 3.2 indicates that methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate. Following Lipinski's Rule of Five, methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate?
The CAS number of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate is 53828-09-4.
What is the molecular formula of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate?
The molecular formula of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate is C19H20N4O2.
What is the molecular weight of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate?
The molecular weight of methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate is 336.15863 g/mol.
Where can I buy methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate?
You can request a quote for methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate?
Yes, CoreyChem provides custom synthesis services for methyl N-[2,2-bis(benzylamino)-1-cyanoethenyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.