CAS 139502-01-5 5-bromo-2-chloro-4-morpholinopyrimidine molecular structure

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CAS RN: 139502-01-5

5-bromo-2-chloro-4-morpholinopyrimidine

Product Availability

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1 package records0 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Lead Time	Inquiry
Batchno.20260125	50mg / 250mg	Out of stock	8-10 business days	Inquiry

Product code: SSC-050137

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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: 5g
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 139502-01-5
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
5g	≥95%	0 Out of Stock	Shenzhen	Inquiry

139502-01-5 / 4-(5-bromo-2-chloropyrimidin-4-yl)morpholine

Standard CAS: 139502-01-5 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

139502-01-5

Multi CAS

Molecular Formula

C8H9BrClN3O

Molecular Weight

278.530000

Exact Mass

276.961750

SMILES

C1COCCN1C2=NC(=NC=C2Br)Cl

InChI

InChI=1S/C8H9BrClN3O/c9-6-5-11-8(10)12-7(6)13-1-3-14-4-2-13/h5H,1-4H2

InChIKey

QSJHIFOKLBHDEH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.5

Rotatable bonds

H-bond acceptors

Molar refractivity

57.77

TPSA

38.25

LogP / Solubility

WLOGP

1.73

MLOGP

1.53

XLogP3

1.9

Consensus LogP

1.72

Log S (ESOL)

-2.91

Class (ESOL)

Moderately soluble

Log S (Ali)

-3.09

Class (Ali)

Poorly soluble

Log S (SILICOS-IT)

-3.03

Class (SILICOS-IT)

Poorly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Log Kp (skin permeation)

-3.19

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Leadlikeness

Yes

Synthetic Accessibility

1.5

5-bromo-2-chloro-4-morpholinopyrimidine

Product Availability

Historical Supply Reference

Reference Pack Sizes

139502-01-5 / 4-(5-bromo-2-chloropyrimidin-4-yl)morpholine

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

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