Name: Name:(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(1H-tetrazol-5-yl)butanoic acid
Brand: Angene
SKU: AG00IJ1B
Rating: 90 (10 reviews)

(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(1H-tetrazol-5-yl)butanoic acid

CAS No.:

954147-36-5

Catalog Number:

AG00IJ1B

Molecular Formula:

C20H19N5O4

Molecular Weight:

393.3960

Catalog Number:

AG00IJ1B

Chemical Name:

(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(1H-tetrazol-5-yl)butanoic acid

CAS Number:

954147-36-5

Molecular Formula:

C20H19N5O4

Molecular Weight:

393.3960

MDL Number:

MFCD26407302

IUPAC Name:

(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(2H-tetrazol-5-yl)butanoic acid

InChI:

InChI=1S/C20H19N5O4/c26-19(27)17(9-10-18-22-24-25-23-18)21-20(28)29-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16-17H,9-11H2,(H,21,28)(H,26,27)(H,22,23,24,25)/t17-/m0/s1

InChI Key:

KCVWFZXYTWJVIX-KRWDZBQOSA-N

SMILES:

O=C(N[C@H](C(=O)O)CCc1nnn[nH]1)OCC1c2ccccc2c2c1cccc2

Complexity:

569

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

393.144g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

393.403g/mol

Monoisotopic Mass:

393.144g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

130A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6