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119670-18-7 | Urea, N-[2-[4-[(2,4-dioxo-5-thiazolidinyl)methyl]phenoxy]ethyl]-N'-phenyl-
CAS No: 119670-18-7 Catalog No: AG000PFM MDL No:
Product Description
Catalog Number:
AG000PFM
Chemical Name:
Urea, N-[2-[4-[(2,4-dioxo-5-thiazolidinyl)methyl]phenoxy]ethyl]-N'-phenyl-
CAS Number:
119670-18-7
Molecular Formula:
C19H19N3O4S
Molecular Weight:
385.4369
IUPAC Name:
1-[2-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]ethyl]-3-phenylurea
InChI:
InChI=1S/C19H19N3O4S/c23-17-16(27-19(25)22-17)12-13-6-8-15(9-7-13)26-11-10-20-18(24)21-14-4-2-1-3-5-14/h1-9,16H,10-12H2,(H2,20,21,24)(H,22,23,25)
InChI Key:
HRVYTGNRRMKBEH-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)NCCOc1ccc(cc1)CC1SC(=O)NC1=O
Properties
Complexity:
531
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.11g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
385.438g/mol
Monoisotopic Mass:
385.11g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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