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CAS 2490297-23-7 INDEX NAME NOT YET ASSIGNED molecular structure lightbox
CAS RN: 2490297-23-7

INDEX NAME NOT YET ASSIGNED

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250310 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-120135
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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: ＞97%
  • 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 2490297-23-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

2490297-23-7 / (4S)-4-benzyl-2-[2-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]-1,3-di(quinolin-2-yl)propan-2-yl]-4,5-dihydro-1,3-oxazole

Standard CAS: 2490297-23-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2490297-23-7
Multi CAS
No
Molecular Formula
C41H36N4O2
Molecular Weight
616.700000
Exact Mass
616.283826
SMILES
C1[C@@H](N=C(O1)C(CC2=NC3=CC=CC=C3C=C2)(CC4=NC5=CC=CC=C5C=C4)C6=N[C@H](CO6)CC7=CC=CC=C7)CC8=CC=CC=C8
InChI
InChI=1S/C41H36N4O2/c1-3-11-29(12-4-1)23-35-27-46-39(44-35)41(25-33-21-19-31-15-7-9-17-37(31)42-33,26-34-22-20-32-16-8-10-18-38(32)43-34)40-45-36(28-47-40)24-30-13-5-2-6-14-30/h1-22,35-36H,23-28H2/t35-,36-/m0/s1
InChIKey
CUXDQYBYYYESQB-ZPGRZCPFSA-N

Computed Properties

Structural Parameters

Heavy atom count
47
Aromatic heavy atom count
32
Fraction Csp3
0.22
Rotatable bonds
10
H-bond acceptors
6
Molar refractivity
187.97
TPSA
68.96

LogP / Solubility

WLOGP
7.63
MLOGP
6.77
XLogP3
7.9
Consensus LogP
7.43
Log S (ESOL)
-8.32
Class (ESOL)
Insoluble
Log S (Ali)
-10.13
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.21
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.06

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
7.5

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