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CAS 2162982-11-6 BAY-218 molecular structure lightbox
CAS RN: 2162982-11-6

BAY-218

Product Availability

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250724 100mg In stock Shanghai Inquiry
Batchno.20260305 10mg In stock Shanghai Inquiry
Batchno.20250302 1g Out of stock Inquiry
Batchno.20251016 250mg In stock Shanghai Inquiry
Batchno.20250210 25mg In stock Shanghai Inquiry
Batchno.20250906 50mg In stock Shanghai Inquiry
  • Product code: SSC-103642
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 2162982-11-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

2162982-11-6 / 6-(4-chlorophenyl)-2-(3-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-oxopyridazine-4-carboxamide

Standard CAS: 2162982-11-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2162982-11-6
Multi CAS
No
Molecular Formula
C20H17ClFN3O3
Molecular Weight
401.800000
Exact Mass
401.094247
SMILES
C[C@@H](CO)NC(=O)C1=CC(=NN(C1=O)C2=CC(=CC=C2)F)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C20H17ClFN3O3/c1-12(11-26)23-19(27)17-10-18(13-5-7-14(21)8-6-13)24-25(20(17)28)16-4-2-3-15(22)9-16/h2-10,12,26H,11H2,1H3,(H,23,27)/t12-/m0/s1
InChIKey
RFGRNBWAUZSMBN-LBPRGKRZSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
18
Fraction Csp3
0.15
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
2
Molar refractivity
104.25
TPSA
84.22

LogP / Solubility

WLOGP
2.8
MLOGP
2.49
XLogP3
3.5
Consensus LogP
2.93
Log S (ESOL)
-4.24
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.88
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.2
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.18

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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