Name: Name:(S)-Benzyl 2-(((Benzyloxy)Carbonyl)Amino)-3-(3,4-Dihydroxyphenyl)Propanoate
Brand: Angene
SKU: AG01DTLD
Rating: 90 (10 reviews)

(S)-Benzyl 2-(((Benzyloxy)Carbonyl)Amino)-3-(3,4-Dihydroxyphenyl)Propanoate

CAS No.:

37169-42-9

Catalog Number:

AG01DTLD

Molecular Formula:

C24H23NO6

Molecular Weight:

421.4425

Catalog Number:

AG01DTLD

Chemical Name:

(S)-Benzyl 2-(((Benzyloxy)Carbonyl)Amino)-3-(3,4-Dihydroxyphenyl)Propanoate

CAS Number:

37169-42-9

Molecular Formula:

C24H23NO6

Molecular Weight:

421.4425

MDL Number:

MFCD30471771

IUPAC Name:

benzyl 3-(3,4-dihydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate

InChI:

InChI=1S/C24H23NO6/c26-21-12-11-19(14-22(21)27)13-20(23(28)30-15-17-7-3-1-4-8-17)25-24(29)31-16-18-9-5-2-6-10-18/h1-12,14,20,26-27H,13,15-16H2,(H,25,29)

InChI Key:

YUJLEWTYSMAYOV-UHFFFAOYSA-N

SMILES:

O=C(N[C@H](C(=O)OCc1ccccc1)Cc1ccc(c(c1)O)O)OCc1ccccc1

Complexity:

558

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

421.153g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

421.449g/mol

Monoisotopic Mass:

421.153g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

105A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7