Akti-1/2

C₃₄H₂₉N₇OCAS 612847-09-3551.65 g/mol

Open in Covalent MOL file

Tertiary amine

Properties

Molecular formula: C₃₄H₂₉N₇O
Molar mass: 551.65 g/mol
Exact mass: 551.2434 Da
logP: 6.32Crippen estimate
Polar surface area: 95.5 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

612847-09-3

SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC4=CC=C(C=C4)C5=C(N=C6C=C7C(=NC=N7)C=C6N5)C8=CC=CC=C8

InChIKey

IWCQHVUQEFDRIW-UHFFFAOYSA-N

InChI

InChI=1S/C34H29N7O/c42-34-39-26-8-4-5-9-31(26)41(34)25-14-16-40(17-15-25)20-22-10-12-24(13-11-22)33-32(23-6-2-1-3-7-23)37-29-18-27-28(36-21-35-27)19-30(29)38-33/h1-13,18-19,21,25,38H,14-17,20H2,(H,39,42)

Weigh it out

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

Names and synonyms

1 names

Akt inhibitor VIII

Work with Akti-1/2

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

Elsewhere

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