1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylbutoxy)-1-benzofuran-5-yl]-3-methylurea,hydrate

Modify Date: 2025-08-25 23:27:11

1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylbutoxy)-1-benzofuran-5-yl]-3-methylurea,hydrate Structure
1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylbutoxy)-1-benzofuran-5-yl]-3-methylurea,hydrate structure
 Common Name 1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylbutoxy)-1-benzofuran-5-yl]-3-methylurea,hydrate
CAS Number 102433-27-2 Molecular Weight 1192.40000
Density N/A Boiling Point N/A
Molecular Formula C60H89N9O16 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylbutoxy)-1-benzofuran-5-yl]-3-methylurea,hydrate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C60H89N9O16
Molecular Weight 1192.40000
Exact Mass 1191.64000
PSA 275.30000
LogP 10.94510
InChIKey IOVIYALQINNPDK-UHFFFAOYSA-N
SMILES CCC(COc1c(NC(=O)NC)c(OC)c2ccoc2c1OC)N1CCCC1.CCC(COc1c(NC(=O)NC)c(OC)c2ccoc2c1OC)N1CCCC1.CCC(COc1c(NC(=O)NC)c(OC)c2ccoc2c1OC)N1CCCC1.O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS9867950
CAS REGISTRY NUMBER :
102433-27-2
LAST UPDATED :
198609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H29-N3-O5.1/3H2-O
MOLECULAR WEIGHT :
397.48
WISWESSER LINE NOTATION :
T56 BOJ FO1 GMVM1 IO1 HO4- AT5NTJ &QH 1/3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
36 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 24,159,1981

 Synonyms

Urea,1-(4,7-dimethoxy-6-(2-(1-pyrrolidinyl)butoxy)-5-benzofuranyl)-3-methyl-,hydrate (3:1)
N-(4,7-Dimethoxy-6-(2-pyrrolidinobutoxy)-5-benzofuranyl)-N'-methylurea hydrate
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Chemsrc provides CAS#:102433-27-2 MSDS, density, melting point, boiling point, structure, etc. Its name is 1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylbutoxy)-1-benzofuran-5-yl]-3-methylurea,hydrate>> amp version: 1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylbutoxy)-1-benzofuran-5-yl]-3-methylurea,hydrate

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