CAS 2757082-19-0 INDEX NAME NOT YET ASSIGNED molecular structure

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CAS RN: 2757082-19-0

INDEX NAME NOT YET ASSIGNED

Product Availability

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5 package records3 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Warehouse	Lead Time	Inquiry
Batchno.20250917	100mg	In stock	Shanghai, Tianjin, Wuhan		Inquiry
Batchno.20250510	100mg / 250mg / 1g	Out of stock		5-7 business days	Inquiry
Batchno.20260321	1g	In stock	Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu		Inquiry
Batchno.20250511	250mg	In stock	Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu		Inquiry
Batchno.20251208	5g	Out of stock			Inquiry

Product code: SSC-127203

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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 2757082-19-0
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	≥95%	0 Out of Stock	Shanghai	Inquiry

2757082-19-0 / (4R)-4-phenyl-2-[1-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]cycloheptyl]-4,5-dihydro-1,3-oxazole

Standard CAS: 2757082-19-0 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

2757082-19-0

Multi CAS

Molecular Formula

C25H28N2O2

Molecular Weight

388.500000

Exact Mass

388.215078

SMILES

C1CCCC(CC1)(C2=N[C@@H](CO2)C3=CC=CC=C3)C4=N[C@@H](CO4)C5=CC=CC=C5

InChI

InChI=1S/C25H28N2O2/c1-2-10-16-25(15-9-1,23-26-21(17-28-23)19-11-5-3-6-12-19)24-27-22(18-29-24)20-13-7-4-8-14-20/h3-8,11-14,21-22H,1-2,9-10,15-18H2/t21-,22-/m0/s1

InChIKey

RUJBMFGGHJDJAB-VXKWHMMOSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.44

Rotatable bonds

H-bond acceptors

Molar refractivity

115.28

TPSA

43.18

LogP / Solubility

WLOGP

5.67

MLOGP

5.01

XLogP3

5.4

Consensus LogP

5.36

Log S (ESOL)

-5.86

Class (ESOL)

Slightly soluble

Log S (Ali)

-6.84

Class (Ali)

Insoluble

Log S (SILICOS-IT)

-7.37

Class (SILICOS-IT)

Insoluble

ADME

GI absorption

Low

BBB permeant

P-gp substrate

CYP1A2 inhibitor

Yes

CYP2C19 inhibitor

Yes

CYP2C9 inhibitor

Yes

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Yes

Log Kp (skin permeation)

-1.07

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Bioavailability score

0.55

Leadlikeness

Synthetic Accessibility

4.5