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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

5-Chloro-2-[(5R)-hexahydro-5-methyl-1H-1,4-diazepin-1-yl]benzoxazole

C[C@H]1NCCN(CC1)c1oc2c(n1)cc(cc2)Cl Request for Quotation
Chemical Name: 5-Chloro-2-[(5R)-hexahydro-5-methyl-1H-1,4-diazepin-1-yl]benzoxazole
CAS Number: 1266975-27-2
Product Number: AG000T4B(AGN-PC-0WALLK)
Synonyms:
MDL No:
Molecular Formula: C13H16ClN3O
Molecular Weight: 265.7386

Identification/Properties

Computed Properties
Molecular Weight:
265.741g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
265.098g/mol
Monoisotopic Mass:
265.098g/mol
Topological Polar Surface Area:
41.3A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
291
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


Application in Chemical Synthesis: (R)-5-Chloro-2-(5-methyl-1,4-diazepan-1-yl)benzo[d]oxazole is a versatile compound that finds wide application in chemical synthesis. Due to its unique structural properties, this compound serves as a valuable building block in the creation of various complex molecules and pharmaceutical compounds. Specifically, its incorporation in organic synthesis enables the systematic modification of its chemical structure to generate novel analogs with potentially enhanced biological activities. This compound’s strategic placement of functional groups facilitates the formation of key intermediates in multi-step synthesis pathways, making it a valuable tool for medicinal chemists and researchers working on drug development projects. As a result, (R)-5-Chloro-2-(5-methyl-1,4-diazepan-1-yl)benzo[d]oxazole plays a crucial role in the advancement of chemical synthesis methods and the discovery of new therapeutic agents.