![1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea structure](/static/products/3922/392237-00-2.webp)
1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea
TL;DR: 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea (CAS 392237-00-2) is a chemical compound with molecular formula C12H16BrN3OS and molecular weight 329.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-bromobenzoyl)amino]-3-tert-butylthiourea
Also Known As: 1-[(3-bromobenzoyl)amino]-3-tert-butylthiourea, 2-(3-bromobenzoyl)-N-(tert-butyl)hydrazinecarbothioamide, 3-BROMO-N-[(TERT-BUTYLCARBAMOTHIOYL)AMINO]BENZAMIDE, (m-bromophenyl)(4-tert-butylthiosemicarbazido)methanone, 2-(3-Bromobenzoyl)-N-tert-butylhydrazine-1-carbothioamide
| Molecular Formula | C12H16BrN3OS |
|---|---|
| Molecular Weight | 329.02 g/mol |
| LogP | 2.3565 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 329.01974 |
| Heavy Atoms | 18 |
| Complexity | 456.8809 |
Chemical Identifiers
| CAS Number | 392237-00-2 |
|---|---|
| SMILES | CC(C)(C)NC(=S)NNC(=O)C1=CC(=CC=C1)Br |
Product Overview
1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea (CAS 392237-00-2), with molecular formula C12H16BrN3OS and molecular weight 329.02 g/mol. IUPAC: 1-[(3-bromobenzoyl)amino]-3-tert-butylthiourea.
Chemical Property Profile of 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea
Property Insights of 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea
The XLogP value of 2.3565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea. With a topological polar surface area (TPSA) of 53.16 Ų, 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea has 3 hydrogen bond donor(s) and 2 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 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea?
The CAS number of 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea is 392237-00-2.
What is the molecular formula of 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea?
The molecular formula of 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea is C12H16BrN3OS.
What is the molecular weight of 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea?
The molecular weight of 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea is 329.02 g/mol.
Where can I buy 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea?
You can request a quote for 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3-Bromobenzoyl)amino]-3-tert-butylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.