Name: Name:2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methylthiazol-2-yl)propanoic acid
Brand: Angene
SKU: AG01DVZD
Rating: 90 (10 reviews)

2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methylthiazol-2-yl)propanoic acid

CAS No.:

1379844-17-3

Catalog Number:

AG01DVZD

Molecular Formula:

C22H20N2O4S

Molecular Weight:

408.4702

Catalog Number:

AG01DVZD

Chemical Name:

2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methylthiazol-2-yl)propanoic acid

CAS Number:

1379844-17-3

Molecular Formula:

C22H20N2O4S

Molecular Weight:

408.4702

MDL Number:

MFCD09918801

IUPAC Name:

2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-methyl-1,3-thiazol-2-yl)propanoic acid

InChI:

InChI=1S/C22H20N2O4S/c1-13-12-29-20(23-13)10-19(21(25)26)24-22(27)28-11-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-9,12,18-19H,10-11H2,1H3,(H,24,27)(H,25,26)

InChI Key:

USYDGGCBXOHSGH-UHFFFAOYSA-N

SMILES:

O=C(NC(C(=O)O)Cc1scc(n1)C)OCC1c2ccccc2c2c1cccc2

Complexity:

581

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

408.114g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

408.472g/mol

Monoisotopic Mass:

408.114g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

117A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1