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CAS 1226776-87-9 7-Boc-3-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine molecular structure lightbox
CAS RN: 1226776-87-9

7-Boc-3-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260215 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-025782
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >97%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1226776-87-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >97% 5 In Stock Beijing Inquiry
0.25g >97% 5 In Stock Hong Kong Inquiry
1g >97% 5 In Stock Shanghai Inquiry
5g >97% 3 In Stock Shenzhen Inquiry

1226776-87-9 / tert-butyl 3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate

Standard CAS: 1226776-87-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1226776-87-9
Multi CAS
No
Molecular Formula
C17H21N3O2
Molecular Weight
299.370000
Exact Mass
299.163377
SMILES
CC(C)(C)OC(=O)N1CCN2C(=NC=C2C3=CC=CC=C3)C1
InChI
InChI=1S/C17H21N3O2/c1-17(2,3)22-16(21)19-9-10-20-14(11-18-15(20)12-19)13-7-5-4-6-8-13/h4-8,11H,9-10,12H2,1-3H3
InChIKey
NCLANSDSIRSLJV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
11
Fraction Csp3
0.41
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
84.31
TPSA
47.36

LogP / Solubility

WLOGP
3.3
MLOGP
2.92
XLogP3
2.1
Consensus LogP
2.77
Log S (ESOL)
-4.08
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.47
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.2

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5

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