N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
TL;DR: N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide (CAS 5919-12-0) is a chemical compound with molecular formula C27H30BrN3O3S and molecular weight 555.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[(2-bromophenyl)carbamoyl-(oxolan-2-ylmethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]acetamide
Also Known As: N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide, N-benzyl-2-[(2-bromophenyl)carbamoyl-(oxolan-2-ylmethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]acetamide
| Molecular Formula | C27H30BrN3O3S |
|---|---|
| Molecular Weight | 555.12 g/mol |
| LogP | 6.06092 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 555.11914 |
| Heavy Atoms | 35 |
| Complexity | 1131.4648 |
Chemical Identifiers
| CAS Number | 5919-12-0 |
|---|---|
| SMILES | CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(CC3CCCO3)C(=O)NC4=CC=CC=C4Br |
Product Overview
N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide (CAS 5919-12-0), with molecular formula C27H30BrN3O3S and molecular weight 555.12 g/mol. IUPAC: N-benzyl-2-[(2-bromophenyl)carbamoyl-(oxolan-2-ylmethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]acetamide.
Chemical Property Profile of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
Property Insights of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
The XLogP value of 6.06092 indicates that N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide. Following Lipinski's Rule of Five, N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide?
The CAS number of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide is 5919-12-0.
What is the molecular formula of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide?
The molecular formula of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide is C27H30BrN3O3S.
What is the molecular weight of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide?
The molecular weight of N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide is 555.12 g/mol.
Where can I buy N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide?
You can request a quote for N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-N~2~-[(2-bromophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.