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CAS 911-77-3 N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride molecular structure lightbox
CAS RN: 911-77-3

N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride

Product Availability

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8 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250507 1g In stock Shandong Inquiry
Batchno.20251127 1g In stock Shanghai Inquiry
Batchno.20251025 250mg In stock Shanghai Inquiry
Batchno.20250129 25g Out of stock 5-7 business days Inquiry
Batchno.20260609 25g Out of stock Inquiry
Batchno.20260225 500mg In stock Shanghai Inquiry
Batchno.20250912 5g In stock Shanghai, Shandong Inquiry
Batchno.20260511 5g In stock Shanghai Inquiry
  • Product code: SSC-203928
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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: 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 911-77-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

911-77-3 / N-[1-benzamido-4-(diaminomethylideneamino)butyl]-4-nitrobenzamide;hydrochloride

Standard CAS: 911-77-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
911-77-3
Multi CAS
Yes
Molecular Formula
C19H23CLN6O4
Molecular Weight
434.900000
Exact Mass
434.146931
InChI
InChI=1S/C19H22N6O4.ClH/c20-19(21)22-12-4-7-16(23-17(26)13-5-2-1-3-6-13)24-18(27)14-8-10-15(11-9-14)25(28)29;/h1-3,5-6,8-11,16H,4,7,12H2,(H,23,26)(H,24,27)(H4,20,21,22);1H
InChIKey
DEPWARHMJHIFAY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
12
Fraction Csp3
0.21
Rotatable bonds
9
H-bond acceptors
5
H-bond donors
4
Molar refractivity
115.42
TPSA
165.74

LogP / Solubility

WLOGP
1.56
MLOGP
1.4
XLogP3
1.56
Consensus LogP
1.51
Log S (ESOL)
-3.22
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.25
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.86
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.27

Drug-likeness / Medicinal Chemistry

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

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