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Chemical structure of NVS-PAK1-C

GC44478

NVS-PAK1-C

Also known as (3S)-3-[[8-chloro-11-(2,2-difluoroethyl)-3-fluoro-5H-benzo[b][1,4]benzodiazepin-6-ylidene]amino]-N,N-dimethylpyrrolidine-1-carboxamide

NVS-PAK1-C is a negative control for the allosteric PAK1 inhibitor NVS-PAK1-1

ChemicalCAS2250019-95-3MW465.9FormulaC22H23ClF3N5O
CAS number
2250019-95-3
Molecular weight
465.9
Formula
C22H23ClF3N5O
Solubility
DMF： 50 mg/ml,DMSO： 50 mg/ml,DMSO：PBS(pH7·2) (1：1)： 0·5 mg/ml,Ethanol： 20 mg/ml
InChIKey
RVHZFZVJXGIAJF-HNNXBMFYSA-N
Catalogue number
GC44478
Brand
GLPBIO
Computed properties PubChem CID 136590564 · XLogP 3.9 · TPSA 51.2 Ų · H-bond donors 1
XLogP
3.9
TPSA
51.2 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
32

SMILES CN(C)C(=O)N1CC[C@@H](C1)N=C2C3=C(C=CC(=C3)Cl)N(C4=C(N2)C=C(C=C4)F)CC(F)F

Computed descriptors from PubChem (CID 136590564), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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