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676235-18-0

676235-18-0 | Acetamide, 2,2'-thiobis[N-[4-(3-methyl-3-phenylcyclobutyl)-2-thiazolyl]-

CAS No: 676235-18-0 Catalog No: AG005LKT MDL No:

Product Description

Catalog Number:
AG005LKT
Chemical Name:
Acetamide, 2,2'-thiobis[N-[4-(3-methyl-3-phenylcyclobutyl)-2-thiazolyl]-
CAS Number:
676235-18-0
Molecular Formula:
C32H34N4O2S3
Molecular Weight:
602.8330
IUPAC Name:
N-[4-(3-methyl-3-phenylcyclobutyl)-1,3-thiazol-2-yl]-2-[2-[[4-(3-methyl-3-phenylcyclobutyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]sulfanylacetamide
InChI:
InChI=1S/C32H34N4O2S3/c1-31(23-9-5-3-6-10-23)13-21(14-31)25-17-40-29(33-25)35-27(37)19-39-20-28(38)36-30-34-26(18-41-30)22-15-32(2,16-22)24-11-7-4-8-12-24/h3-12,17-18,21-22H,13-16,19-20H2,1-2H3,(H,33,35,37)(H,34,36,38)
InChI Key:
CYMKNWYCBCJSQC-UHFFFAOYSA-N
SMILES:
O=C(Nc1scc(n1)C1CC(C1)(C)c1ccccc1)CSCC(=O)Nc1scc(n1)C1CC(C1)(C)c1ccccc1

Properties

Complexity:
841  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
602.184g/mol
Formal Charge:
0
Heavy Atom Count:
41  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
602.83g/mol
Monoisotopic Mass:
602.184g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
166A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2  

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