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CAS 29427-58-5 O-METHYLISOUREA SULFATE molecular structure lightbox
CAS RN: 29427-58-5

O-METHYLISOUREA SULFATE

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250805 100g In stock Shandong, Hebei Inquiry
Batchno.20260620 25g In stock Shandong Inquiry
Batchno.20251215 500g Out of stock 5-7 business days Inquiry
Batchno.20260104 5g In stock Shanghai Inquiry
  • Product code: SSC-132287
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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: 100g
  • 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 29427-58-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Shanghai Inquiry

29427-58-5 / methyl carbamimidate;sulfuric acid

Standard CAS: 29427-58-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
29427-58-5
Multi CAS
Yes
Molecular Formula
C2H8N2O5S
Molecular Weight
172.160000
Exact Mass
172.015393
InChI
InChI=1S/C2H6N2O.H2O4S/c1-5-2(3)4;1-5(2,3)4/h1H3,(H3,3,4);(H2,1,2,3,4)
InChIKey
MDFRYRPNRLLJHT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
4
Molar refractivity
33.1
TPSA
133.7

LogP / Solubility

WLOGP
-1.13
MLOGP
-0.99
XLogP3
-1.13
Consensus LogP
-1.08
Log S (ESOL)
-0.2
Class (ESOL)
Very soluble
Log S (Ali)
-0.16
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.16
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.57

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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