RefChem:1086880
TL;DR: RefChem:1086880 (CAS 186453-62-3) is a chemical compound with molecular formula C22H30N4OS and molecular weight 398.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-[(4-propan-2-yloxyphenyl)methyl]thiourea
Also Known As: Hydrazinecarbothioamide, 2-((4-(diethylamino)phenyl)methylene)-N-((4-(1-methylethoxy)phenyl)methyl)-, 1-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-[(4-propan-2-yloxyphenyl)methyl]thiourea, 3-[(4-diethylaminophenyl)methylideneamino]-1-[(4-propan-2-yloxyphenyl)methyl]thiourea, N-((3-Bromo-4-ethoxyphenyl)methyl)-2-((2-hydroxyphenyl)methylene)hydrazinecarbothioamide, Hydrazinecarbothioamide, 2-((4-(diethylamino)phenyl)methylene)-N-((4-( 1-methylethoxy)phenyl)methyl)
| Molecular Formula | C22H30N4OS |
|---|---|
| Molecular Weight | 398.21 g/mol |
| LogP | 4.3182 |
| Topological Polar Surface Area | 48.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 398.21402 |
| Heavy Atoms | 28 |
| Complexity | 753.11115 |
Chemical Identifiers
| CAS Number | 186453-62-3 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=N/NC(=S)NCC2=CC=C(C=C2)OC(C)C |
Product Overview
RefChem:1086880 (CAS 186453-62-3), with molecular formula C22H30N4OS and molecular weight 398.21 g/mol. IUPAC: 1-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-[(4-propan-2-yloxyphenyl)methyl]thiourea.
Chemical Property Profile of RefChem:1086880
Property Insights of RefChem:1086880
The XLogP value of 4.3182 indicates that RefChem:1086880 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.89 Ų, RefChem:1086880 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1086880 has 2 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 RefChem:1086880?
The CAS number of RefChem:1086880 is 186453-62-3.
What is the molecular formula of RefChem:1086880?
The molecular formula of RefChem:1086880 is C22H30N4OS.
What is the molecular weight of RefChem:1086880?
The molecular weight of RefChem:1086880 is 398.21 g/mol.
Where can I buy RefChem:1086880?
You can request a quote for RefChem:1086880 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1086880?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1086880 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.