Basic information
- CAS
27885-92-3- Standard SMILES
O=C(Nc1cccc(C2=NCCN2)c1)Nc1cccc(C2=NCCN2)c1- InChIKey
SCEVFJUWLLRELN-UHFFFAOYSA-N- Molecular formula
- C19H20N6O
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.16985926
Overview
Imidocarb is a member of ureas. It has a role as an antiprotozoal drug.
Names & identifiers
- Preferred name
- Imidocarb
- IUPAC
- 1,3-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea
- English name
- Imidocarb
- Molecular formula
- C19H20N6O
- Molecular weight
- 348.4
Names & synonyms
Show more names
Database identifiers
- CAS
27885-92-3- PubChem CID
- 21389
- DTXSID
DTXSID0048345- ChEMBL
CHEMBL427342- ChEBI
CHEBI:51804- UNII
- 8USS3K0VDH
- EC Number
- 248-711-7
- Nikkaji
- J20.350E
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 526
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 235 °C · >235°C (dec.)
- Density
- 1.39 · 1.39±0.1 g/cm3(Predicted)
- storage temp.
- Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly, Heated)
- pka
- 13.81 · 13.81±0.70(Predicted)
- form
- Solid
- color
- White to Off-White
- InChI
- InChI=1S/C19H20N6O/c26-19(24-15-5-1-3-13(11-15)17-20-7-8-21-17)25-16-6-2-4-14(12-16)18-22-9-10-23-18/h1-6,11-12H,7-10H2,(H,20,21)(H,22,23)(H2,24,25,26)
- InChIKey
- SCEVFJUWLLRELN-UHFFFAOYSA-N
- SMILES
- N(C1=CC=CC(C2NCCN=2)=C1)C(NC1=CC=CC(C2NCCN=2)=C1)=O
- CAS DataBase Reference
- 27885 · 27885-92-3(CAS DataBase Reference)
- FDA UNII
- 8 USS3K0VDH · 8USS3K0VDH
- Symbol(GHS)
- 7 · GHS07,GHS08
- Signal word
- Danger
- Hazard statements
- 302 · H302-H361-H370
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- REACH Registrations
- Inactive
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P264, P270, P280, P301+P317, P308+P316, P318, P319, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 36 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS08
- Hazard statements
- H302-H361-H370
- REACH Registrations
- Inactive
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Pharmacology
Uses & manufacturing
Use Classification
Veterinary Drug -> ANTIPROTOZOAL_AGENT -> JECFA Functional Classes
Veterinary Drug -> ANTIPROTOZOAL_AGENT -> JECFA Functional Classes
Applications
UsesImidocarb is a urea derived antiprotozoal agent used in veterinary medicine for the treatment of infection with babesia and other parasites.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Additional notes
DefinitionChEBI: Imidocarb is a member of ureas. It has a role as an antiprotozoal drug.
Related reactions
No reaction records under the current filter.
Compound notes
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