Fmoc-tranexamic acid

C23H25NO4CAS 167690-53-1379.46 g/mol

Open in Covalent MOL file
NHOOOHO
CarbamateCarboxylic acid

Properties

Molecular formula
C23H25NO4
Molar mass
379.46 g/mol
Exact mass
379.1784 Da
logP
4.42Crippen estimate
Polar surface area
75.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
5

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
167690-53-1
SMILES
C1CC(CCC1CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O
InChIKey
MLMIBGARTUSGND-UHFFFAOYSA-N
InChI
InChI=1S/C23H25NO4/c25-22(26)16-11-9-15(10-12-16)13-24-23(27)28-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-8,15-16,21H,9-14H2,(H,24,27)(H,25,26)

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Fmoc-tranexamic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Fmoc-dap(fmoc)-oh201473-90-768 % similar Boc-dap(fmoc)-oh122235-70-560 % similar Fmoc-lys(fmoc)-oh78081-87-559 % similar Fmoc-isonipecotic acid148928-15-858 % similar Fmoc-L-phenylglycine102410-65-158 % similar Fmoc-D-phg-oh111524-95-958 % similar Fmoc-dap(aloc)-oh188970-92-558 % similar (2S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)-3,3-dimethylbutanoic acid132684-60-757 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Fmoc-chg-oh161321-36-4 Fmoc-D-chg-oh198543-96-3 (S)-2-(((9H-Fluoren-9-yl)methoxy)carbonylamino)-2-methylhept-6-enoic acid288617-73-2 (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-cyclopentylpropanoic acid371770-32-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook