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CAS 1092970-12-1 Morphothiadin molecular structure lightbox
CAS RN: 1092970-12-1

Morphothiadin

Product Availability

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8 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260125 1mg / 5mg / 50mg Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260411 100mg In stock Shanghai Inquiry
Batchno.20260523 10mg In stock Shanghai Inquiry
Batchno.20260517 1mg In stock Shanghai Inquiry
Batchno.20260503 250mg Out of stock Inquiry
Batchno.20250922 25mg In stock Shanghai Inquiry
Batchno.20260502 50mg In stock Shanghai Inquiry
Batchno.20250305 5mg In stock Shanghai Inquiry
  • Product code: SSC-010546
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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: 0.1g
  • 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 1092970-12-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Hong Kong Inquiry

1092970-12-1 / ethyl 4-(2-bromo-4-fluorophenyl)-6-(morpholin-4-ylmethyl)-2-(1,3-thiazol-2-yl)-1,4-dihydropyrimidine-5-carboxylate

Morphothiadine | R8MEF6D6PS | GLS-4

Standard CAS: 1092970-12-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1092970-12-1
Multi CAS
No
Molecular Formula
C21H22BrFN4O3S
Molecular Weight
509.400000
Exact Mass
508.058000
SMILES
CCOC(=O)C1=C(NC(=NC1C2=C(C=C(C=C2)F)Br)C3=NC=CS3)CN4CCOCC4
InChI
InChI=1S/C21H22BrFN4O3S/c1-2-30-21(28)17-16(12-27-6-8-29-9-7-27)25-19(20-24-5-10-31-20)26-18(17)14-4-3-13(23)11-15(14)22/h3-5,10-11,18H,2,6-9,12H2,1H3,(H,25,26)
InChIKey
SQGRDKSRFFUBBU-UHFFFAOYSA-N
Synonyms
Morphothiadine R8MEF6D6PS GLS-4 RefChem:1090028 Morphothiadin

Computed Properties

Structural Parameters

Heavy atom count
31
Aromatic heavy atom count
11
Fraction Csp3
0.38
Rotatable bonds
6
H-bond acceptors
8
H-bond donors
1
Molar refractivity
119.55
TPSA
76.05

LogP / Solubility

WLOGP
3.29
MLOGP
2.93
XLogP3
2.5
Consensus LogP
2.91
Log S (ESOL)
-4.93
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.11
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.42
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.49

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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