![Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate structure](/static/products/1022/1022594-77-9.webp)
Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate
TL;DR: Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate (CAS 1022594-77-9) is a chemical compound with molecular formula C22H21N3O3 and molecular weight 375.1583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate
Also Known As: Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate, Benzyl (4-((3-aminophenyl)carbamoyl)benzyl)carbamate, Benzyl ({4-[(3-aminophenyl)carbamoyl]phenyl}methyl)carbamate, benzyln-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate
Technical Specifications
| Molecular Formula | C22H21N3O3 |
| Molecular Weight | 375.1583 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 93.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 375.1583 Da |
| Heavy Atoms | 28 |
| Complexity | 499.0 |
| SMILES | C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)N |
| InChIKey | LOTNXFQCJQWAAZ-UHFFFAOYSA-N |
Chemical Property Profile of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate
Property Insights of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate
The XLogP value of 3.1 indicates that Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate. Following Lipinski's Rule of Five, Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate?
The CAS number of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate is 1022594-77-9.
What is the molecular formula of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate?
The molecular formula of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate is C22H21N3O3.
What is the molecular weight of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate?
The molecular weight of Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate is 375.1583 g/mol.
Where can I buy Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate?
You can request a quote for Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate?
Yes, CoreyChem provides custom synthesis services for Benzyl N-[[4-[(3-aminophenyl)carbamoyl]phenyl]methyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.