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CAS 1211525-35-7 4-Amino-5-bromofuro[2,3-d]pyrimidine molecular structure lightbox
CAS RN: 1211525-35-7

4-Amino-5-bromofuro[2,3-d]pyrimidine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250623 100mg / 250mg / 500mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1211525-35-7
  • Purity/Analytical Methods: >99.0%
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1211525-35-7 / 5-bromofuro[2,3-d]pyrimidin-4-amine

4-AMINO-5-BROMOFURO[2,3-D]PYRIMIDINE | 5-BROMOFURO[2,3-D]PYRIMIDIN-4-AMINE | MFCD18254937

Standard CAS: 1211525-35-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1211525-35-7
Multi CAS
No
Molecular Formula
C6H4BrN3O
Molecular Weight
214.020000
Exact Mass
212.953770
SMILES
C1=C(C2=C(N=CN=C2O1)N)Br
InChI
InChI=1S/C6H4BrN3O/c7-3-1-11-6-4(3)5(8)9-2-10-6/h1-2H,(H2,8,9,10)
InChIKey
UWXSLPNUDZRXII-UHFFFAOYSA-N
Synonyms
4-AMINO-5-BROMOFURO[2,3-D]PYRIMIDINE 5-BROMOFURO[2,3-D]PYRIMIDIN-4-AMINE MFCD18254937 SCHEMBL22659243 DTXSID301292130

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
4
H-bond donors
1
Molar refractivity
43.92
TPSA
64.94

LogP / Solubility

WLOGP
1.57
MLOGP
1.38
XLogP3
1.3
Consensus LogP
1.42
Log S (ESOL)
-2.76
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.45
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.35
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.91

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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