BRD-K93621072-001-06-6
TL;DR: BRD-K93621072-001-06-6 (CAS 817570-99-3) is a chemical compound with molecular formula C15H16ClN3O2S2 and molecular weight 369.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]-2,2-dimethylpropanamide
Also Known As: BRD-K93621072-001-06-6, N-({2-[(3-chloro-1-benzothien-2-yl)carbonyl]hydrazino}carbonothioyl)-2,2-dimethylpropanamide, N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]-2,2-dimethylpropanamide, N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]-2,2-dimethyl-propanamide, N-[[(3-chlorobenzothiophene-2-carbonyl)amino]thiocarbamoyl]-2,2-dimethyl-propionamide
| Molecular Formula | C15H16ClN3O2S2 |
|---|---|
| Molecular Weight | 369.04 g/mol |
| LogP | 3.2363 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 369.03726 |
| Heavy Atoms | 23 |
| Complexity | 780.6102 |
Chemical Identifiers
| CAS Number | 817570-99-3 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC(=S)NNC(=O)C1=C(C2=CC=CC=C2S1)Cl |
Product Overview
BRD-K93621072-001-06-6 (CAS 817570-99-3), with molecular formula C15H16ClN3O2S2 and molecular weight 369.04 g/mol. IUPAC: N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]-2,2-dimethylpropanamide.
Chemical Property Profile of BRD-K93621072-001-06-6
Property Insights of BRD-K93621072-001-06-6
The XLogP value of 3.2363 indicates that BRD-K93621072-001-06-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K93621072-001-06-6. Following Lipinski's Rule of Five, BRD-K93621072-001-06-6 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
Frequently Asked Questions
What is the CAS number of BRD-K93621072-001-06-6?
The CAS number of BRD-K93621072-001-06-6 is 817570-99-3.
What is the molecular formula of BRD-K93621072-001-06-6?
The molecular formula of BRD-K93621072-001-06-6 is C15H16ClN3O2S2.
What is the molecular weight of BRD-K93621072-001-06-6?
The molecular weight of BRD-K93621072-001-06-6 is 369.04 g/mol.
Where can I buy BRD-K93621072-001-06-6?
You can request a quote for BRD-K93621072-001-06-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K93621072-001-06-6?
Yes, KEHONG BIO provides custom synthesis services for BRD-K93621072-001-06-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.