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CAS 65148-07-4 Furo[2,3-d]pyriMidine, 4-chloro-5,6-diphenyl- molecular structure lightbox
CAS RN: 65148-07-4

Furo[2,3-d]pyriMidine, 4-chloro-5,6-diphenyl-

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Batchno.20250719 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS65148-07-4
  • Purity/Analytical Methods: >99.0%
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65148-07-4 / 4-chloro-5,6-diphenylfuro[2,3-d]pyrimidine

Standard CAS: 65148-07-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
65148-07-4
Multi CAS
No
Molecular Formula
C18H11CLN2O
Molecular Weight
306.700000
Exact Mass
306.055991
InChI
InChI=1S/C18H11ClN2O/c19-17-15-14(12-7-3-1-4-8-12)16(13-9-5-2-6-10-13)22-18(15)21-11-20-17/h1-11H
InChIKey
DZCDERJEEHCRHG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
21
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
87.69
TPSA
38.92

LogP / Solubility

WLOGP
5.21
MLOGP
4.6
XLogP3
5.2
Consensus LogP
5
Log S (ESOL)
-5.6
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.84
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.22
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.89

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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