chempirical

Lasofoxifene tartrate

C32H37NO8CAS 190791-29-8563.65 g/mol

Open in Covalent MOL file
OHOOHOHOOHHOON
AlcoholCarboxylic acidEtherPhenolTertiary amine

Properties

Molecular formula
C32H37NO8
Molar mass
563.65 g/mol
Exact mass
563.2519 Da
logP
3.61Crippen estimate
Polar surface area
147.8 Ų
H-bond donors / acceptors
5 / 7
Rotatable bonds
9
Stereocentres
S, S, S, Rin SMILES atom order

Identifiers

CAS number
190791-29-8
SMILES
O=C(O)[C@@H](O)[C@H](O)C(=O)O.Oc1ccc2c(c1)CC[C@H](c1ccccc1)[C@@H]2c1ccc(OCCN2CCCC2)cc1
InChIKey
INEHJXCWEVNEDZ-LUDNRVPPSA-N
InChI
InChI=1S/C28H31NO2.C4H6O6/c30-24-11-15-27-23(20-24)10-14-26(21-6-2-1-3-7-21)28(27)22-8-12-25(13-9-22)31-19-18-29-16-4-5-17-29;5-1(3(7)8)2(6)4(9)10/h1-3,6-9,11-13,15,20,26,28,30H,4-5,10,14,16-19H2;1-2,5-6H,(H,7,8)(H,9,10)/t26-,28+;1-,2-/m10/s1

Weigh it out

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

Names and synonyms

7 names
  • 2-Naphthalenol, 5,6,7,8-tetrahydro-6-phenyl-5-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-, (5R,6S)-, (2S,3S)-2,3-dihydroxybutanedioate (1:1)
  • 2-Naphthalenol, 5,6,7,8-tetrahydro-6-phenyl-5-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-, (5R-cis)-, [S-(R*,R*)]-2,3-dihydroxybutanedioate (1:1) (salt)
  • 2-Naphthalenol, 5,6,7,8-tetrahydro-6-phenyl-5-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-, (5R,6S)-, (2S,3S)-2,3-dihydroxybutanedioate (1:1) (salt)
  • CP 336156
  • CB 336156EB
  • Oporia
  • Fablyn

Work with Lasofoxifene tartrate

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

Raloxifene84449-90-136 % similar Ifenprodil tartrate23210-58-435 % similar 4-(2-Piperidinoethoxy)benzoic acid hydrochloride84449-80-935 % similar Tolterodine tartrate124937-52-635 % similar Raloxifene hydrochloride82640-04-834 % similar Phenylephrine tartrate17162-39-933 % similar Bazedoxifene acetate198481-33-333 % similar (-)-Nicotine hydrogen (+)-tartrate2624-48-833 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Tamoxifen citrate54965-24-1

Elsewhere

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