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146827-31-8 | Urea, N-(2,3-dihydro-7-phenoxy-1H-pyrrolo[1,2-a]indol-1-yl)-N-hydroxy-
CAS No: 146827-31-8 Catalog No: AG001ED9 MDL No:
Product Description
Catalog Number:
AG001ED9
Chemical Name:
Urea, N-(2,3-dihydro-7-phenoxy-1H-pyrrolo[1,2-a]indol-1-yl)-N-hydroxy-
CAS Number:
146827-31-8
Molecular Formula:
C18H17N3O3
Molecular Weight:
323.3459
IUPAC Name:
1-hydroxy-1-(6-phenoxy-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)urea
InChI:
InChI=1S/C18H17N3O3/c19-18(22)21(23)16-8-9-20-15-7-6-14(10-12(15)11-17(16)20)24-13-4-2-1-3-5-13/h1-7,10-11,16,23H,8-9H2,(H2,19,22)
InChI Key:
JZRKEVDEKWYZSQ-UHFFFAOYSA-N
SMILES:
NC(=O)N(C1CCn2c1cc1c2ccc(c1)Oc1ccccc1)O
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.127g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
323.352g/mol
Monoisotopic Mass:
323.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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