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RBC10

CAT: 0127-BUP07945-04Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP07945-04Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
362503-73-9
Synonyms
RBC 10, RBC-10
Purity
=98%
Smiles
CCCCC(=O)N1C(C2=C(CCCC2=O)Nc2ccccc12)c1ccccc1Cl

Chemical Information

11-(2-chlorophenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
CAS Number362503-73-9
PubChem CID22330351
IUPAC Name6-(2-chlorophenyl)-5-pentanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Molecular FormulaC24H25ClN2O2
Molecular Weight408.9
XLogP4.8
Topological Polar Surface Area49.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity661
SMILES
CCCCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC=CC=C4Cl
InChI
InChI=1S/C24H25ClN2O2/c1-2-3-15-22(29)27-20-13-7-6-11-18(20)26-19-12-8-14-21(28)23(19)24(27)16-9-4-5-10-17(16)25/h4-7,9-11,13,24,26H,2-3,8,12,14-15H2,1H3
InChIKey
XERBEDAMDXRGFD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 11-(2-chlorophenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
CAS: 362503-73-9
CID: 22330351
Formula: C24H25ClN2O2
MW: 408.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight408.9
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass408.1604557
Monoisotopic Mass408.1604557
Topological Polar Surface Area49.4 Ų
Heavy Atom Count29
Formal Charge0
Complexity661
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
BA5805-5.1RBC10
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A22098-200RBC10 200mg
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A22098-1RBC10 1mg
A22098-50RBC10 50mg
A22098-25RBC10 25mg
A22098-2RBC10 2mg
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