CAS 2757082-02-1 INDEX NAME NOT YET ASSIGNED molecular structure

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CAS RN: 2757082-02-1

INDEX NAME NOT YET ASSIGNED

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1 package records0 with current stock1 grade group

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Batch No.	Package	Availability	Lead Time	Inquiry
Batchno.20260417	100mg / 250mg / 1g	Out of stock	5-7 business days	Inquiry

Product code: SSC-127198

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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
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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 2757082-02-1
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	＞97%	0 Out of Stock	Shanghai	Inquiry

2757082-02-1 / (4R)-4-tert-butyl-2-[2-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-1,3-dihydroinden-2-yl]-4,5-dihydro-1,3-oxazole

Standard CAS: 2757082-02-1 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

2757082-02-1

Multi CAS

Molecular Formula

C23H32N2O2

Molecular Weight

368.500000

Exact Mass

368.246378

SMILES

CC(C)(C)[C@@H]1COC(=N1)C2(CC3=CC=CC=C3C2)C4=N[C@@H](CO4)C(C)(C)C

InChI

InChI=1S/C23H32N2O2/c1-21(2,3)17-13-26-19(24-17)23(11-15-9-7-8-10-16(15)12-23)20-25-18(14-27-20)22(4,5)6/h7-10,17-18H,11-14H2,1-6H3/t17-,18-/m0/s1

InChIKey

GABYPOAAACQAAR-ROUUACIJSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.65

Rotatable bonds

H-bond acceptors

Molar refractivity

109.54

TPSA

43.18

LogP / Solubility

WLOGP

4.46

MLOGP

3.94

XLogP3

4.9

Consensus LogP

4.43

Log S (ESOL)

-4.97

Class (ESOL)

Slightly soluble

Log S (Ali)

-5.8

Class (Ali)

Slightly soluble

Log S (SILICOS-IT)

-6

Class (SILICOS-IT)

Slightly soluble

ADME

GI absorption

High

BBB permeant

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

Yes

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Yes

Log Kp (skin permeation)

-1.8

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Yes

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Leadlikeness

Synthetic Accessibility

INDEX NAME NOT YET ASSIGNED

Product Availability

Historical Supply Reference

Reference Pack Sizes

2757082-02-1 / (4R)-4-tert-butyl-2-[2-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-1,3-dihydroinden-2-yl]-4,5-dihydro-1,3-oxazole

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

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