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CAS 1433860-44-6 2(1H)-Pyridinone,5-bromo-1-methyl-3-[[5-[(2R)-2-methyl-4-(3-oxetanyl)-1-piperazinyl]-2-pyridinyl]amino]- molecular structure lightbox
CAS RN: 1433860-44-6

2(1H)-Pyridinone,5-bromo-1-methyl-3-[[5-[(2R)-2-methyl-4-(3-oxetanyl)-1-piperazinyl]-2-pyridinyl]amino]-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251031 1g Out of stock 15 business days Inquiry
  • Product code: SSC-054769
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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: 1g
  • 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 1433860-44-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1433860-44-6 / 5-bromo-1-methyl-3-[[5-[(2R)-2-methyl-4-(oxetan-3-yl)piperazin-1-yl]-2-pyridinyl]amino]pyridin-2-one

Standard CAS: 1433860-44-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1433860-44-6
Multi CAS
No
Molecular Formula
C19H24BrN5O2
Molecular Weight
434.300000
Exact Mass
433.111340
SMILES
C[C@@H]1CN(CCN1C2=CN=C(C=C2)NC3=CC(=CN(C3=O)C)Br)C4COC4
InChI
InChI=1S/C19H24BrN5O2/c1-13-9-24(16-11-27-12-16)5-6-25(13)15-3-4-18(21-8-15)22-17-7-14(20)10-23(2)19(17)26/h3-4,7-8,10,13,16H,5-6,9,11-12H2,1-2H3,(H,21,22)/t13-/m1/s1
InChIKey
VGRKPWHLVRPNAO-CYBMUJFWSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.47
Rotatable bonds
4
H-bond acceptors
7
H-bond donors
1
Molar refractivity
109.89
TPSA
62.63

LogP / Solubility

WLOGP
2.2
MLOGP
1.96
XLogP3
1.9
Consensus LogP
2.02
Log S (ESOL)
-3.98
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.71
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.79
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.81

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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