기본 정보
- CAS
847270-33-1- 표준 SMILES
CCCn1c(=N)c(C(=O)NCCc2ccc(OC)c(OC)c2)cc2c(=O)n3cccc(C)c3nc21- InChIKey
IPCFEFKOMCZVQA-UHFFFAOYSA-N- 분자식
- C26H29N5O4
- 평균 분자량
- 475.5 g/mol
이름 및 식별자
- 우선 이름
- N-[2-(3,4-Dimethoxyphenyl)ethyl]-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
- IUPAC
- N-[2-(3,4-dimethoxyphenyl)ethyl]-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
- 영어명
- N-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-10-methyl-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
- 분자식
- C26H29N5O4
- 분자량
- 475.54
이름 및 동의어
847270-33-1N-[2-(3,4-Dimethoxyphenyl)ethyl]-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamideN-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-10-methyl-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamideSTK707318AKOS005182097AO-022/43455351Z1213741310N-(3,4-dimethoxyphenethyl)-2-imino-10-methyl-5-oxo-1-propyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamideN-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-10-methyl-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide2H-Dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-1,5-dihydro-2-imino-10-methyl-5-oxo-1-propyl-
데이터베이스 식별자
- CAS
847270-33-1
물성
구조 계산 물성
- XLogP
- 2.7
- 극성 표면적
- 107 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 1,050
화학 및 산업
공급사4 곳
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