200,000+ products from a single source!
sales@angenechem.com
1820574-30-8 | 2H-Tetrazole-5-butanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2-(triphenylmethyl)-, (αR)-
CAS No: 1820574-30-8 Catalog No: AG0023AY MDL No:
Product Description
Catalog Number:
AG0023AY
Chemical Name:
2H-Tetrazole-5-butanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2-(triphenylmethyl)-, (αR)-
CAS Number:
1820574-30-8
Molecular Formula:
C39H33N5O4
Molecular Weight:
635.7104
IUPAC Name:
2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(2-trityltetrazol-5-yl)butanoic acid
InChI:
InChI=1S/C39H33N5O4/c45-37(46)35(40-38(47)48-26-34-32-22-12-10-20-30(32)31-21-11-13-23-33(31)34)24-25-36-41-43-44(42-36)39(27-14-4-1-5-15-27,28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-23,34-35H,24-26H2,(H,40,47)(H,45,46)
InChI Key:
KAVTYNLYJFKSFA-UHFFFAOYSA-N
SMILES:
O=C(N[C@@H](C(=O)O)CCc1nnn(n1)C(c1ccccc1)(c1ccccc1)c1ccccc1)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
989
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
635.253g/mol
Formal Charge:
0
Heavy Atom Count:
48
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
635.724g/mol
Monoisotopic Mass:
635.253g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
8
Related Products
© 2019 Angene International Limited. All rights Reserved.