3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoicacid | CAS No. 754159-68-7

3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoicacid

Basic Information

CAS Number

754159-68-7

Molecular Formula

C29H35NO3

Molecular Weight

445.59 g/mol

AD

Basic Physical Properties

Density

1.095

CC(C)N(CCC(C1=CC=CC=C1)C2=C(C=CC(=C2)C(=O)O)OCC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C29H35NO3/c1-21(2)30(22(3)4)18-17-26(24-13-9-6-10-14-24)27-19-25(29(31)32)15-16-28(27)33-20-23-11-7-5-8-12-23/h5-16,19,21-22,26H,17-18,20H2,1-4H3,(H,31,32)/t26-/m1/s1

InChIKey

KJWIVHKZEWPBJI-AREMUKBSSA-N

LogP

6.604600000000007

Topological Polar Surface Area

49.769999999999996 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

557

Synonyms & References

English

  • 754159-68-7
  • Benzoicacid, 3-[(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)-
  • SCHEMBL1783715
  • CS-0002393
  • AKOS015901746
  • KJWIVHKZEWPBJI-AREMUKBSSA-N
  • 3-[(1R)-3-[BIS(1-METHYLETHYL)AMINO]-1-PHENYLPROPYL]-4-(PHENYLMETHOXY)BENZOIC ACID
  • (R)-4-benzyloxy-3-(3-diisopropylamino-1-phenylpropyl)-benzoic acid
  • 4-benzyloxy-3-[(1R)-3-(diisopropylamino)-1-phenyl-propyl]benzoic acid
  • 3-[(1R)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-phenylmethoxybenzoic acid
  • AC-23944
  • 4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

MDL Number

MFCD16619336

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