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CAS 103478-12-2 BENZYL (S)-(2-OXOAZEPAN-3-YL)CARBAMATE molecular structure lightbox
CAS RN: 103478-12-2

BENZYL (S)-(2-OXOAZEPAN-3-YL)CARBAMATE

Product Availability

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5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250810 1g In stock Shanghai Inquiry
Batchno.20250616 1g In stock Tianjin Inquiry
Batchno.20250521 250mg Out of stock 8-10 business days Inquiry
Batchno.20251219 250mg In stock Tianjin Inquiry
Batchno.20260426 5g Out of stock Inquiry
  • Product code: SSC-005021
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 0.25g, 5g
  • Available purity: >97%
  • Inventory rows with stock: 1
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 103478-12-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 1 In Stock Shanghai Inquiry
0.25g >97% 0 Out of Stock Hong Kong Inquiry
5g >97% 0 Out of Stock Shenzhen Inquiry

103478-12-2 / benzyl N-[(3S)-2-oxoazepan-3-yl]carbamate

Benzyl (2-oxoazepan-3-yl)carbamate | benzyl N-(2-oxoazepan-3-yl)carbamate | benzyl 2-oxoazepan-3-ylcarbamate

Standard CAS: 103478-12-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
103478-12-2
Multi CAS
Yes
Molecular Formula
C14H18N2O3
Molecular Weight
262.300000
Exact Mass
262.131742
SMILES
C1CCNC(=O)[C@H](C1)NC(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C14H18N2O3/c17-13-12(8-4-5-9-15-13)16-14(18)19-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,15,17)(H,16,18)/t12-/m0/s1
InChIKey
ZFWYCTUOFGJWRJ-LBPRGKRZSA-N
Synonyms
Benzyl (2-oxoazepan-3-yl)carbamate benzyl N-(2-oxoazepan-3-yl)carbamate benzyl 2-oxoazepan-3-ylcarbamate benzyl (r)-2-oxoazepan-3-ylcarbamate Benzyl(2-oxoazepan-3-yl)carbamate

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.43
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
70.41
TPSA
67.43

LogP / Solubility

WLOGP
1.58
MLOGP
1.4
XLogP3
1.7
Consensus LogP
1.56
Log S (ESOL)
-2.5
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.85
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.04
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.2

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

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