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CAS 74927-72-3 (R)-(-)-N-(3,5-Dinitrobenzoyl)-α-phenylglycine molecular structure lightbox
CAS RN: 74927-72-3

(R)-(-)-N-(3,5-Dinitrobenzoyl)-α-phenylglycine

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250520 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-184410
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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: 25g
  • Available purity: ≥97%
  • 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 74927-72-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Beijing Inquiry

74927-72-3 / (2R)-2-[(3,5-dinitrobenzoyl)amino]-2-phenylacetic acid

Standard CAS: 74927-72-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
74927-72-3
Multi CAS
Yes
Molecular Formula
C15H11N3O7
Molecular Weight
345.260000
Exact Mass
345.059700
InChI
InChI=1S/C15H11N3O7/c19-14(16-13(15(20)21)9-4-2-1-3-5-9)10-6-11(17(22)23)8-12(7-10)18(24)25/h1-8,13H,(H,16,19)(H,20,21)/t13-/m1/s1
InChIKey
MIVUDAUOXJDARR-CYBMUJFWSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
6
H-bond acceptors
6
H-bond donors
2
Molar refractivity
84.04
TPSA
152.68

LogP / Solubility

WLOGP
2.06
MLOGP
1.83
XLogP3
2.1
Consensus LogP
2
Log S (ESOL)
-3.24
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.88
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.33
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.36

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3

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