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CAS 477351-96-5 4-Bromo-2,6-bis[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]-pyridine molecular structure lightbox
CAS RN: 477351-96-5

4-Bromo-2,6-bis[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]-pyridine

Product Availability

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4 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251231 100mg Out of stock Inquiry
Batchno.20260415 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
Batchno.20260604 1g Out of stock Inquiry
Batchno.20250617 250mg In stock Shanghai Inquiry
  • Product code: SSC-154667
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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 477351-96-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

477351-96-5 / (4S)-2-[4-bromo-6-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole

Standard CAS: 477351-96-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
477351-96-5
Multi CAS
Yes
Molecular Formula
BC17H22O2Rn3
Molecular Weight
380.300000
Exact Mass
379.089540
InChI
InChI=1S/C17H22BrN3O2/c1-9(2)14-7-22-16(20-14)12-5-11(18)6-13(19-12)17-21-15(8-23-17)10(3)4/h5-6,9-10,14-15H,7-8H2,1-4H3/t14-,15-/m1/s1
InChIKey
UZZFMJXCTBUSMU-HUUCEWRRSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
6
Fraction Csp3
0.59
Rotatable bonds
4
H-bond acceptors
5
Molar refractivity
94.17
TPSA
56.07

LogP / Solubility

WLOGP
3.45
MLOGP
3.05
XLogP3
4
Consensus LogP
3.5
Log S (ESOL)
-4.3
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.17
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.47
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.59

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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