![1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea structure](/static/products/3989/398998-07-7.webp)
1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea
TL;DR: 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea (CAS 398998-07-7) is a chemical compound with molecular formula C27H31N5OS and molecular weight 473.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(4-benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea
Also Known As: F0840-0123, 1-[3-(4-benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea, 3-[4-(DIPHENYLMETHYL)PIPERAZIN-1-YL]-N-[(PHENYLCARBAMOTHIOYL)AMINO]PROPANAMIDE, 2-(3-(4-benzhydrylpiperazin-1-yl)propanoyl)-N-phenylhydrazinecarbothioamide, 1-[3-(4-benzhydrylpiperazin-1-yl)propanoylamino]-3-phenyl-thiourea
| Molecular Formula | C27H31N5OS |
|---|---|
| Molecular Weight | 473.22 g/mol |
| LogP | 3.8015 |
| Topological Polar Surface Area | 59.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 473.22495 |
| Heavy Atoms | 34 |
| Complexity | 1000.8901 |
Chemical Identifiers
| CAS Number | 398998-07-7 |
|---|---|
| SMILES | C1CN(CCN1CCC(=O)NNC(=S)NC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea (CAS 398998-07-7), with molecular formula C27H31N5OS and molecular weight 473.22 g/mol. IUPAC: 1-[3-(4-benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea.
Chemical Property Profile of 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea
Property Insights of 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea
The XLogP value of 3.8015 indicates that 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.64 Ų, 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea 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 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea?
The CAS number of 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea is 398998-07-7.
What is the molecular formula of 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea?
The molecular formula of 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea is C27H31N5OS.
What is the molecular weight of 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea?
The molecular weight of 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea is 473.22 g/mol.
Where can I buy 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea?
You can request a quote for 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(4-Benzhydrylpiperazin-1-yl)propanoylamino]-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.