![3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide structure](/static/products/817/817188-82-2.png)
3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide
TL;DR: 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide (CAS 817188-82-2) is a chemical compound with molecular formula C18H23BrN2O3S and molecular weight 426.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide
Also Known As: AN-329/42795121, 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide, 3-bromo-N-[(cyclopropylmethyl)(tetrahydrofuran-2-ylmethyl)carbamothioyl]-4-methoxybenzamide, 3-bromo-N-{[(cyclopropylmethyl)(tetrahydro-2-furanylmethyl)amino]carbonothioyl}-4-methoxybenzamide, N'-(3-bromo-4-methoxybenzoyl)-N-(cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)thiourea
| Molecular Formula | C18H23BrN2O3S |
|---|---|
| Molecular Weight | 426.06 g/mol |
| LogP | 3.3634 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.06128 |
| Heavy Atoms | 25 |
| Complexity | 645.2084 |
Chemical Identifiers
| CAS Number | 817188-82-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)N(CC2CC2)CC3CCCO3)Br |
Product Overview
3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide (CAS 817188-82-2), with molecular formula C18H23BrN2O3S and molecular weight 426.06 g/mol. IUPAC: 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide.
Chemical Property Profile of 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide
Property Insights of 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide
The XLogP value of 3.3634 indicates that 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide 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 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide?
The CAS number of 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide is 817188-82-2.
What is the molecular formula of 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide?
The molecular formula of 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide is C18H23BrN2O3S.
What is the molecular weight of 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide?
The molecular weight of 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide is 426.06 g/mol.
Where can I buy 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide?
You can request a quote for 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.