200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 865087-85-0
865087-85-0 | D-LEUCINE, N-ACETYL-, COMPD. WITH (1R)-1-(2,3-DIHYDRO-5-BENZOFURANYL)-2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE (1:1)
CAS No: 865087-85-0 Catalog No: AG004Q4U MDL No:
Product Description
Catalog Number:
AG004Q4U
Chemical Name:
D-LEUCINE, N-ACETYL-, COMPD. WITH (1R)-1-(2,3-DIHYDRO-5-BENZOFURANYL)-2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE (1:1)
CAS Number:
865087-85-0
Molecular Formula:
C27H33N3O4
Molecular Weight:
463.5686
IUPAC Name:
(2R)-2-acetamido-4-methylpentanoic acid;(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
InChI:
InChI=1S/C19H18N2O.C8H15NO3/c1-2-4-16-14(3-1)15-7-9-20-18(19(15)21-16)13-5-6-17-12(11-13)8-10-22-17;1-5(2)4-7(8(11)12)9-6(3)10/h1-6,11,18,20-21H,7-10H2;5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t18-;7-/m11/s1
InChI Key:
XMBXRIKUABVYAF-SPULLRLGSA-N
SMILES:
C1Oc2c(C1)cc(cc2)[C@H]1NCCc2c1[nH]c1c2cccc1.CC(C[C@H](C(=O)O)NC(=O)C)C
Properties
Complexity:
591
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
463.247g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
463.578g/mol
Monoisotopic Mass:
463.247g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.