![N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide structure](/static/products/817/817188-83-3.png)
N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide
TL;DR: N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide (CAS 817188-83-3) is a chemical compound with molecular formula C20H21BrN2O2S and molecular weight 432.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide
Also Known As: N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide, AN-329/42795122, N-{[benzyl(cyclopropylmethyl)amino]carbonothioyl}-3-bromo-4-methoxybenzamide, N-benzyl-N'-(3-bromo-4-methoxybenzoyl)-N-(cyclopropylmethyl)thiourea
| Molecular Formula | C20H21BrN2O2S |
|---|---|
| Molecular Weight | 432.05 g/mol |
| LogP | 4.3846 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 432.05072 |
| Heavy Atoms | 26 |
| Complexity | 793.65314 |
Chemical Identifiers
| CAS Number | 817188-83-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)N(CC2CC2)CC3=CC=CC=C3)Br |
Product Overview
N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide (CAS 817188-83-3), with molecular formula C20H21BrN2O2S and molecular weight 432.05 g/mol. IUPAC: N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide.
Chemical Property Profile of N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide
Property Insights of N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide
The XLogP value of 4.3846 indicates that N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide has 1 hydrogen bond donor(s) and 3 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 N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide?
The CAS number of N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide is 817188-83-3.
What is the molecular formula of N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide?
The molecular formula of N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide is C20H21BrN2O2S.
What is the molecular weight of N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide?
The molecular weight of N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide is 432.05 g/mol.
Where can I buy N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide?
You can request a quote for N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[benzyl(cyclopropylmethyl)carbamothioyl]-3-bromo-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.