CS-0674766
(S)-3-Amino-5-methyl-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]oxazepine-7-carbonitrile hydrochloride
Manufacturer: ChemScene
CAS Number: 2911582-43-7
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₁₂ClN₃O₂
Molecular Weight
253.68
Synonyms
None
SMILES
CN1C2=CC(C#N)=CC=C2OC[C@@H](C1=O)N.Cl
Tpsa
79.35
Logp
0.66258
H Acceptors
4
H Donors
1
Rotatable Bonds
0
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂ClN₃O₂
Molecular Weight: 253.68
Synonyms: None
SMILES: CN1C2=CC(C#N)=CC=C2OC[C@@H](C1=O)N.Cl
Tpsa: 79.35
Logp: 0.66258
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂ClN₃O₂
Molecular Weight:
253.68
Synonyms:
None
SMILES:
CN1C2=CC(C#N)=CC=C2OC[C@@H](C1=O)N.Cl
Tpsa:
79.35
Logp:
0.66258
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₆N₂OS
Molecular Weight: 200.30
Synonyms: None
SMILES: N[C@H](C)C1=NC(C(C)(OC)C)=CS1
Tpsa: 48.14
Logp: 2.0443
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₆N₂OS
Molecular Weight:
200.30
Synonyms:
None
SMILES:
N[C@H](C)C1=NC(C(C)(OC)C)=CS1
Tpsa:
48.14
Logp:
2.0443
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉BrN₂O₂
Molecular Weight: 245.07
Synonyms: None
SMILES: O=C(C1=C(N)C=C(Br)N=C1)OCC
Tpsa: 65.21
Logp: 1.603
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉BrN₂O₂
Molecular Weight:
245.07
Synonyms:
None
SMILES:
O=C(C1=C(N)C=C(Br)N=C1)OCC
Tpsa:
65.21
Logp:
1.603
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₈BrN₃O₄
Molecular Weight: 372.21
Synonyms: None
SMILES: O=C(OC(C)(C)C)N[C@@H]1C(N(C)C2=NC=C(Br)C=C2OC1)=O
Tpsa: 80.76
Logp: 2.0926
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₈BrN₃O₄
Molecular Weight:
372.21
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N[C@@H]1C(N(C)C2=NC=C(Br)C=C2OC1)=O
Tpsa:
80.76
Logp:
2.0926
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1