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675585-66-7 | L-Serine, O-[[3-[5-(9H-carbazol-9-yl)pentyl]-5-isoxazolyl]methyl]-
CAS No: 675585-66-7 Catalog No: AG006011 MDL No:
Product Description
Catalog Number:
AG006011
Chemical Name:
L-Serine, O-[[3-[5-(9H-carbazol-9-yl)pentyl]-5-isoxazolyl]methyl]-
CAS Number:
675585-66-7
Molecular Formula:
C24H27N3O4
Molecular Weight:
421.4889
IUPAC Name:
(2S)-2-amino-3-[[3-(5-carbazol-9-ylpentyl)-1,2-oxazol-5-yl]methoxy]propanoic acid
InChI:
InChI=1S/C24H27N3O4/c25-21(24(28)29)16-30-15-18-14-17(26-31-18)8-2-1-7-13-27-22-11-5-3-9-19(22)20-10-4-6-12-23(20)27/h3-6,9-12,14,21H,1-2,7-8,13,15-16,25H2,(H,28,29)/t21-/m0/s1
InChI Key:
DELDQPNTVRXBQU-NRFANRHFSA-N
SMILES:
OC(=O)[C@H](COCc1onc(c1)CCCCCn1c2ccccc2c2c1cccc2)N
Properties
Complexity:
555
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
421.2g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
421.497g/mol
Monoisotopic Mass:
421.2g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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