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29414-01-5 | Acetamide, 2,2'-thiobis[N-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-
CAS No: 29414-01-5 Catalog No: AG002YAK MDL No:
Product Description
Catalog Number:
AG002YAK
Chemical Name:
Acetamide, 2,2'-thiobis[N-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-
CAS Number:
29414-01-5
Molecular Formula:
C32H48N2O4S
Molecular Weight:
556.7995
IUPAC Name:
2-[2-(3,5-ditert-butyl-4-hydroxyanilino)-2-oxoethyl]sulfanyl-N-(3,5-ditert-butyl-4-hydroxyphenyl)acetamide
InChI:
InChI=1S/C32H48N2O4S/c1-29(2,3)21-13-19(14-22(27(21)37)30(4,5)6)33-25(35)17-39-18-26(36)34-20-15-23(31(7,8)9)28(38)24(16-20)32(10,11)12/h13-16,37-38H,17-18H2,1-12H3,(H,33,35)(H,34,36)
InChI Key:
QDTNNAFMDUCCER-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)CSCC(=O)Nc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
Properties
Complexity:
717
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
556.333g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
556.806g/mol
Monoisotopic Mass:
556.333g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7
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