Home Carbonyls 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(1,3-thiazol-4-yl)acetic acid

2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(1,3-thiazol-4-yl)acetic acid

CAS No.:
1690925-94-0
Catalog Number:
AG01BKC2
Molecular Formula:
C20H16N2O4S
Molecular Weight:
380.4170
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Product Description
Catalog Number:
AG01BKC2
Chemical Name:
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(1,3-thiazol-4-yl)acetic acid
CAS Number:
1690925-94-0
Molecular Formula:
C20H16N2O4S
Molecular Weight:
380.4170
MDL Number:
MFCD30285329
IUPAC Name:
2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-(1,3-thiazol-4-yl)acetic acid
InChI:
InChI=1S/C20H16N2O4S/c23-19(24)18(17-10-27-11-21-17)22-20(25)26-9-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,10-11,16,18H,9H2,(H,22,25)(H,23,24)
InChI Key:
LTSBULMUGXSSFY-UHFFFAOYSA-N
SMILES:
O=C(NC(c1cscn1)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
538  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.083g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
380.418g/mol
Monoisotopic Mass:
380.083g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties